Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 2/20 | 0.38 |
| ▸ | CA2 known ✓ | P00918 | 2/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | HBB | P68871 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8153475 | 0.95 | PABPC1 (0.41) | PABPC1EIF4HCTDSP1CA12CA2 | |
| SCHEMBL8773420 | 0.87 | CA12 (0.41) | PABPC1EIF4HCTDSP1CA12CA2 | |
| Tetrabuthylammonium SCHEMBL1113137 | 0.84 | SMN1; SMN2 (0.39) | PABPC1EIF4HCTDSP1SMN1; SMN2RXFP1 | |
| SCHEMBL1114157 | 0.84 | PABPC1 (0.42) | PABPC1EIF4HCTDSP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11015342 | 0.83 | CA2 (0.37) | CA2CYP3A4TDP1 | |
| Acetoacetic Acid SCHEMBL11104714 | 0.82 | PABPC1 (0.32) | PABPC1EIF4HCTDSP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1114122 | 0.81 | PABPC1 (0.48) | PABPC1EIF4HCTDSP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1114339 | 0.81 | SMN1; SMN2 (0.39) | PABPC1EIF4HCTDSP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8158074 | 0.80 | SMN1; SMN2 (0.34) | ALDH1A1SMN1; SMN2LMNATSHRPMP22 | |
| SCHEMBL8159899 | 0.79 | SMN1; SMN2 (0.33) | ALDH1A1SMN1; SMN2LMNATSHRKDM4E |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0350922-B1 | Process for catalyst-aldehyde product separation | UNION CARBIDE CHEM PLASTIC (US) | 1994-09-21 | — | — | EP | claimed |
| US-5180854-A | Separation of aldehyde from rhodium phosphorous ligand with solvent | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1993-01-19 | — | — | US | claimed |
| EP-0350922-A2 | Process for catalyst-aldehyde product separation | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (a New York corporation) (US) | 1990-01-17 | — | — | EP | claimed |
| EP-0805139-B1 | HYDROFORMYLATION METHOD | KURARAY CO (JP) | 2000-04-26 | — | — | EP | disclosed |
| US-5773666-A | CARRYING OUT REACTION IN THE PRESENCE OF A RHODIUM COMPOUND, A TERTIARY ORGANIC PHOSPHINE AND A POLAR ORGANIC COMPOUND | KURARAY CO., LTD. (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0805139-A1 | HYDROFORMYLATION METHOD | KURARAY CO., LTD. (JP) | 1997-11-05 | — | — | EP | disclosed |
| EP-0350922-B1 | Process for catalyst-aldehyde product separation | UNION CARBIDE CHEM PLASTIC (US) | 1994-09-21 | — | — | EP | disclosed |
| US-5180854-A | Separation of aldehyde from rhodium phosphorous ligand with solvent | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1993-01-19 | — | — | US | disclosed |
| EP-0350922-A2 | Process for catalyst-aldehyde product separation | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (a New York corporation) (US) | 1990-01-17 | — | — | EP | disclosed |