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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL29703182 | 1.00 | CA2 (0.39) | CA2TP53KDM4ECYP3A4CA5A | |
| Sulfuric Acid SCHEMBL11851135 | 0.85 | CA5A (0.50) | CA2KDM4ECYP3A4CA5ACA5B | |
| SCHEMBL3864847 | 0.80 | TP53 (0.36) | CA2TP53CYP3A4MEN1KMT2A | |
| Methenamine SCHEMBL10952551 | 0.79 | CA2 (0.39) | CA2KDM4ECYP3A4CA5ACA5B | |
| SCHEMBL25599 | 0.76 | CA2 (0.58) | CA2TP53KDM4ECYP3A4CA5A | |
| SCHEMBL8596055 | 0.76 | CA2 (0.58) | CA2TP53KDM4ECYP3A4CA5A | |
| SCHEMBL105 | 0.76 | — | — | |
| SCHEMBL15109974 | 0.76 | — | — | |
| SCHEMBL246838 | 0.76 | CA2 (0.58) | CA2TP53KDM4ECYP3A4CA5A | |
| SCHEMBL128169 | 0.76 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0948564-B1 | MODIFYING AGENTS FOR POLYOLEFINS | MINNESOTA MINING & MFG (US) | 2002-07-24 | — | — | EP | disclosed |
| EP-0948564-A1 | MODIFYING AGENTS FOR POLYOLEFINS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998029496-A1 | MODIFYING AGENTS FOR POLYOLEFINS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-07-09 | — | — | WO | disclosed |