Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.43 |
| ▸ | NQO1 | P15559 | 6/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | GNG2 | P59768 | 1/20 | 0.35 |
| ▸ | GNB1 | P62873 | 1/20 | 0.35 |
| ▸ | SELP | P16109 | 1/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | BAD | Q92934 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.33 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27584193 | 0.87 | GNG2 (0.47) | KIF11NQO1CDK4CCND1GNG2 | |
| SCHEMBL27338114 | 0.85 | NQO1 (0.41) | KIF11NQO1CDK4CCND1GNG2 | |
| SCHEMBL28199787 | 0.85 | KIF11 (0.44) | KIF11NQO1CDK4CCND1GNG2 | |
| Anthracene SCHEMBL28161518 | 0.82 | GNG2 (0.43) | KIF11NQO1CDK4CCND1GNG2 | |
| Piperazine SCHEMBL27836342 | 0.79 | KIF11 (0.42) | KIF11NQO1CDK4CCND1GNG2 | |
| SCHEMBL28815383 | 0.79 | KIF11 (0.39) | KIF11NQO1CDK4CCND1GNG2 | |
| SCHEMBL27409389 | 0.77 | NQO1 (0.43) | KIF11NQO1CDK4CCND1SELP | |
| SCHEMBL27288088 | 0.76 | KIF11 (0.47) | KIF11NQO1CDK4CCND1BCL2L1 | |
| SCHEMBL30662035 | 0.75 | BCL2L1 (0.48) | KIF11NQO1CDK4CCND1BCL2L1 | |
| SCHEMBL27632129 | 0.75 | KIF11 (0.46) | KIF11NQO1CDK4CCND1BCL2L1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1630636-A | Indoline derivatives and their use as 5-HT2 receptor ligands | HOFFMANN LA ROCHE (CH) | 2005-06-22 | — | — | CN | disclosed |
| CN-1187330-C | Indole derivatives, process for their preparation, pharmaceutical compositions containing them and their medicinal application | VERNALIS RES LTD (GB) | 2005-02-02 | — | — | CN | disclosed |
| CN-1368960-A | Indole derivatives, process for their preparation, pharmaceutical compositions containing them and their medical use | VERNALIS RES LTD (GB) | 2002-09-11 | — | — | CN | disclosed |
| CN-1042421-C | Acridine derivatives | GLAXO LAB SA (FR) | 1999-03-10 | — | — | CN | disclosed |
| CN-1081181-A | Acridine derivatives | GLAXO LAB SA (FR) | 1994-01-26 | — | — | CN | disclosed |