Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 12/20 | 0.44 |
| ▸ | GSK3B | P49841 | 12/20 | 0.44 |
| ▸ | CCNB2 | O95067 | 11/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 11/20 | 0.44 |
| ▸ | CCNB3 | Q8WWL7 | 11/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 5/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 4/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.39 |
| ▸ | GSK3A | P49840 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9851857 | 0.83 | GSK3B (0.40) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL5256403 | 0.78 | OPRM1 (0.39) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL10416854 | 0.71 | CNR1 (0.46) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL4135918 | 0.69 | CREBBP (0.46) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL31289276 | 0.69 | TOP2A (0.49) | KDM4EHSD17B10MEN1NPC1ALDH1A1 | |
| SCHEMBL10923868 | 0.69 | TOP2A (0.49) | KDM4EHSD17B10MEN1NPC1ALDH1A1 | |
| SCHEMBL9851806 | 0.67 | HTR2A (0.40) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL792582 | 0.66 | CCNB2 (0.39) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL18202213 | 0.65 | PABPC1 (0.49) | CDK5CDK5R1CREBBPKDM4EHSD17B10 | |
| SCHEMBL6399576 | 0.63 | EPHX2 (0.44) | CDK1GSK3BCCNB2CCNB1CCNB3 |
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-0406719-A1 | 4h-indolo(1,2-d)(1,2,4)triazolo (4,3-a)(1,4)benzodiazepines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-01-09 | — | — | EP | disclosed |
| US-4914201-A | CHEMICAL INTERMEDIATES FOR ANALGESICS | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1990-04-03 | — | — | US | disclosed |
| US-4897392-A | ANALGESICS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1990-01-30 | — | — | US | disclosed |