Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.45 |
| ▸ | RAB9A | P51151 | 7/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ESRRG | P62508 | 2/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | CCKBR | P32239 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9538757 | 0.85 | MTNR1A (0.50) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9539323 | 0.82 | MMP8 (0.51) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9700657 | 0.81 | MMP8 (0.46) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9538003 | 0.81 | MMP8 (0.46) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9539180 | 0.80 | MMP8 (0.44) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9540255 | 0.80 | MMP8 (0.44) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9538098 | 0.80 | MMP8 (0.44) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL8486077 | 0.80 | CCKBR (0.61) | MAPTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9699668 | 0.80 | CCKBR (0.53) | MMP8NPC1RAB9AMAPTPOLB | |
| SCHEMBL9540074 | 0.79 | RAB9A (0.51) | MMP8NPC1RAB9AOPRK1ALDH1A1 |
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-1993003721-A1 | CHOLECYSTOKININ ANTAGONISTS USEFUL FOR TREATING DEPRESSION | WARNER-LAMBERT COMPANY (US) | 1993-03-04 | — | — | WO | disclosed |