Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.59 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | DDO | Q99489 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL935681 | 0.76 | KDR (0.65) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL5076094 | 0.75 | KDR (1.00) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL29370693 | 0.75 | KDR (1.00) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL4025864 | 0.73 | KDR (0.64) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL5051826 | 0.72 | KDR (0.68) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL15520113 | 0.72 | CHEK1 (0.62) | CHEK1 | |
| SCHEMBL172747 | 0.72 | KDR (0.62) | KDRCHEK1RAB9ANPC1KDM4E | |
| SCHEMBL15520678 | 0.71 | KDR (0.57) | KDRCHEK1RAB9ANPC1KDM4E | |
| Methane SCHEMBL28704887 | 0.70 | KDR (0.66) | KDRCHEK1RAB9ANPC1KDM4E | |
| Benzene SCHEMBL27629233 | 0.70 | RAB9A (0.69) | KDRCHEK1RAB9ANPC1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2294065-B1 | INDOLYL-PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY | VERNALIS R&D LTD (GB) | 2014-03-19 | — | — | EP | claimed |