Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 4/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8306238 | 0.89 | CDK5 (0.60) | CDK5CDK5R1CA12CA1CA2 | |
| SCHEMBL8308055 | 0.84 | MEN1 (0.60) | CDK5CDK5R1CA12CA1CA2 | |
| SCHEMBL8444391 | 0.84 | CDK5 (0.55) | CDK5CDK5R1CA12CA1CA2 | |
| SCHEMBL16382914 | 0.84 | RAB9A (0.63) | CA12CA9KDM4EMEN1NPC1 | |
| SCHEMBL8305443 | 0.81 | CA12 (0.72) | CDK5CDK5R1CA12CA1CA2 | |
| SCHEMBL2929691 | 0.78 | CDK5 (0.55) | CDK5CDK5R1CA12CA1CA2 | |
| SCHEMBL7518475 | 0.78 | CYP19A1 (0.65) | KDM4EMEN1NPC1ALDH1A1HPGD | |
| SCHEMBL16382924 | 0.78 | KMT2A (0.62) | CA12CA9KDM4EMEN1NPC1 | |
| SCHEMBL18470546 | 0.78 | CYP1A1 (0.57) | KDM4EMEN1NPC1ALDH1A1HPGD | |
| SCHEMBL16382913 | 0.78 | CYP19A1 (0.60) | CA12CA9KDM4EMEN1NPC1 |
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-0915848-A1 | 1,2-DIARYLINDOLE AS COX-2 INHIBITORS | LABORATOIRES UPSA (FR) | 1999-05-19 | — | — | EP | disclosed |
| US-5723485-A | ANALGESIC, ANTIINFLAMMATORY AGENTS | LABORATORIES UPSA (FR) | 1998-03-03 | — | — | US | disclosed |
| WO-1998005639-A1 | 1,2-DIARYLINDOLE AS COX-2 INHIBITORS | LABORATOIRES UPSA (FR) | 1998-02-12 | — | — | WO | disclosed |