Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DUT | P33316 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.36 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.36 |
| ▸ | TK1 | P04183 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4762320 | 1.00 | DUT (0.39) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL4763266 | 0.98 | DUT (0.40) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL5699551 | 0.98 | DUT (0.40) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL5699516 | 0.89 | KIF11 (0.36) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL3623796 | 0.89 | KIF11 (0.36) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL8687134 | 0.83 | KIF11 (0.39) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL4193339 | 0.83 | PLA2G2A (0.36) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL4186763 | 0.81 | DUT (0.44) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL4186770 | 0.81 | DUT (0.44) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 | |
| SCHEMBL26439425 | 0.80 | PLA2G2A (0.42) | DUTPLA2G2APLA2G10PLA2G1BPLA2G5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1341927-B1 | METHOD OF PREPARING 3-¬2-{(METHYLSULFONYL)OXY}ETHOXY|-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG IND OHIO INC (US) | 2006-08-02 | — | — | EP | claimed |
| EP-1341927-A1 | METHOD OF PREPARING 3- 2- (METHYLSULFONYL)OXY ETHOXY]-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG Industries Ohio, Inc. (US) | 2003-09-10 | — | — | EP | claimed |
| WO-2002059342-A1 | METHOD OF PREPARING 3-[2-{(METHYLSULFONYL)OXY}ETHOXY]-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG INDUSTRIES OHIO, INC. (US) | 2002-08-01 | — | — | WO | claimed |
| US-6300106-B1 | FORMING S-ISOMER OR R-ISOMER OF (3,6-DIHYDRO-2H-PYRAN-2-YL)-METHANOL VIA A PROCESS WHICH PRODUCES A RACEMIC MIXTURE OF INTERMEDIATE REACTION PRODUCTS, RESOLVING TO SELECTIVELY PRODUCE S ISOMER | PPG INDUSTRIES OHIO, INC. | 2001-10-09 | — | — | US | claimed |
| JP-2008263985-A | METHOD OF PREPARING 3-[2-{(METHYLSULFONYL)OXY}ETHOXY]-4-(TRIPHENYLMETHOXY)-1-BUTANOL METHANESULFONATE | PPG IND OHIO INC | 2008-11-06 | — | — | JP | disclosed |
| CN-1276978-C | Method of preparing 3-[2-{(methylsulfonyl)oxy}ethoxy]-4-(triphenylmethoxy)-1-butanol, methane sulfonate | PPG IND OHIO INC (US) | 2006-09-27 | — | — | CN | disclosed |
| EP-1341927-B1 | METHOD OF PREPARING 3-¬2-{(METHYLSULFONYL)OXY}ETHOXY|-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG IND OHIO INC (US) | 2006-08-02 | — | — | EP | disclosed |
| CN-1633504-A | Method of preparing 3-[2-{(methylsulfonyl)oxy}ethoxy]-4-(triphenylmethoxy)-1-butanol, methane sulfonate | PPG IND OHIO INC (US) | 2005-06-29 | — | — | CN | disclosed |
| EP-1341927-A1 | METHOD OF PREPARING 3- 2- (METHYLSULFONYL)OXY ETHOXY]-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG Industries Ohio, Inc. (US) | 2003-09-10 | — | — | EP | disclosed |
| WO-2002059342-A1 | METHOD OF PREPARING 3-[2-{(METHYLSULFONYL)OXY}ETHOXY]-4-(TRIPHENYLMETHOXY)-1-BUTANOL, METHANE SULFONATE | PPG INDUSTRIES OHIO, INC. (US) | 2002-08-01 | — | — | WO | disclosed |
| US-6300106-B1 | FORMING S-ISOMER OR R-ISOMER OF (3,6-DIHYDRO-2H-PYRAN-2-YL)-METHANOL VIA A PROCESS WHICH PRODUCES A RACEMIC MIXTURE OF INTERMEDIATE REACTION PRODUCTS, RESOLVING TO SELECTIVELY PRODUCE S ISOMER | PPG INDUSTRIES OHIO, INC. | 2001-10-09 | — | — | US | disclosed |
| US-6300106-B1 | FORMING S-ISOMER OR R-ISOMER OF (3,6-DIHYDRO-2H-PYRAN-2-YL)-METHANOL VIA A PROCESS WHICH PRODUCES A RACEMIC MIXTURE OF INTERMEDIATE REACTION PRODUCTS, RESOLVING TO SELECTIVELY PRODUCE S ISOMER | PPG INDUSTRIES OHIO, INC. | 2001-10-09 | — | — | US | disclosed |
| US-5665877-A | Synthesis of bisindolylmaleimides | ELI LILLY AND COMPANY (US) | 1997-09-09 | — | — | US | disclosed |
| EP-0776899-A1 | Intermediates and their use to prepare N,N'-bridged bisindolylmaleimides | ELI LILLY AND COMPANY (US) | 1997-06-04 | — | — | EP | disclosed |
| EP-0776895-A1 | Protein kinase C inhibitor | ELI LILLY AND COMPANY (US) | 1997-06-04 | — | — | EP | disclosed |
| WO-1997018809-A1 | PROTEIN KINASE C INHIBITOR | ELI LILLY AND COMPANY (US) | 1997-05-29 | — | — | WO | disclosed |
| WO-1997019080-A1 | NOVEL INTERMEDIATES AND THEIR USE TO PREPARE N,N'-BRIDGED BISINDOLYLMALEIMIDES | ELI LILLY AND COMPANY (US) | 1997-05-29 | — | — | WO | disclosed |
| US-5614647-A | Intermediates for the synthesis of bisindolylmaleimides | ELI LILLY AND COMPANY (US) | 1997-03-25 | — | — | US | disclosed |
| US-5541347-A | Synthesis of bisindolylmaleimides | ELI LILLY AND COMPANY (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0657411-A1 | Improved synthesis of bisindolylmaleimides | ELI LILLY AND COMPANY (US) | 1995-06-14 | — | — | EP | disclosed |