Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 3/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1446427 | 0.84 | BCL2 (0.50) | BCL2MCL1HSP90AB1PPARGPPARA | |
| SCHEMBL3079937 | 0.84 | CYP2C9 (0.42) | HSP90AB1PPARGPPARAMAPTKDM4E | |
| SCHEMBL2855431 | 0.79 | PPARG (0.46) | BCL2MCL1HSP90AB1PPARGPPARA | |
| SCHEMBL2868258 | 0.77 | HPGD (0.47) | BCL2MCL1HSP90AB1PPARGPPARA | |
| SCHEMBL29236376 | 0.73 | BCL2 (0.49) | BCL2MCL1PPARGPPARAGABRA1 | |
| SCHEMBL2862125 | 0.73 | MAPT (0.49) | BCL2MCL1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL23135752 | 0.72 | BCL2 (0.49) | BCL2MCL1GABRA1GABRB1MAPT | |
| SCHEMBL29236379 | 0.72 | HPGD (0.47) | BCL2MCL1PPARGPPARAGABRA1 | |
| SCHEMBL2855392 | 0.71 | BCL2 (0.43) | BCL2MCL1MAPTKDM4EMAPK1 | |
| SCHEMBL27543079 | 0.70 | AKR1C3 (0.52) | BCL2MCL1MAPTPTGS1CXCR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7795166-B2 | Functional group-selective hydrogenation catalyst and functional group-selective hydrogenation method | N.E. CHEMCAT CORPORATION (JP) | 2010-09-14 | — | — | US | disclosed |
| US-20070155617-A1 | FUNCTIONAL GROUP-SELECTIVE HYDROGENATION CATALYST AND FUNCTIONAL GROUP-SELECTIVE HYDROGENATION METHOD | N. E. CHEMCAT CORPORATION (JP) | 2007-07-05 | — | — | US | disclosed |