Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 6/20 | 0.45 |
| ▸ | PIM1 | P11309 | 3/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL8349193 | 0.82 | ROCK1 (0.48) | ROCK1PIM1PIM2NISCHAKR1B1 | |
| SCHEMBL8352818 | 0.72 | MCL1 (0.40) | PIM1PIM2NISCHAKR1B1KDM4E | |
| SCHEMBL13119265 | 0.69 | CYP2A6 (0.52) | ROCK1PIM1PIM2CYP2A6AKR1B1 | |
| SCHEMBL6820987 | 0.69 | ROCK1 (0.39) | ROCK1PIM1PIM2CYP2A6AKR1B1 | |
| SCHEMBL8295552 | 0.68 | ROCK1 (0.56) | ROCK1PIM1PIM2CYP2A6AKR1B1 | |
| SCHEMBL6824684 | 0.67 | ROCK1 (0.39) | ROCK1PIM1PIM2CYP2A6AKR1B1 | |
| SCHEMBL10431976 | 0.65 | CYP2A6 (0.47) | ROCK1PIM1PIM2CYP2A6AKR1B1 | |
| SCHEMBL3631532 | 0.65 | RAB9A (0.50) | NISCHKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL8542466 | 0.64 | ALDH1A1 (0.49) | NISCHNPC1RAB9AALDH1A1CYP1A2 | |
| SCHEMBL31429694 | 0.64 | IDO1 (0.51) | PIM1NISCHKDM4ENPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999032112-A1 | METHOD FOR TREATING DIABETES | ELI LILLY AND COMPANY (US) | 1999-07-01 | — | — | WO | disclosed |