Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | SELE | P16581 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.30 |
| ▸ | ALB | P02768 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2406710 | 0.79 | CYP2A6 (0.35) | CYP2A6TYR | |
| SCHEMBL2222194 | 0.73 | — | — | |
| SCHEMBL12302873 | 0.70 | KDM4E (0.31) | KDM4EMAPTALOX15 | |
| SCHEMBL336602 | 0.70 | — | — | |
| SCHEMBL6626975 | 0.70 | — | — | |
| SCHEMBL8089179 | 0.70 | — | — | |
| SCHEMBL12070250 | 0.69 | TRPA1 (0.32) | — | |
| SCHEMBL21737573 | 0.67 | LMNA (0.33) | — | |
| SCHEMBL21737236 | 0.67 | — | — | |
| SCHEMBL11764805 | 0.67 | CYP2A6 (0.39) | CYP2A6ALDH1A1SMN1; SMN2ICAM1SELE |
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 |
|---|---|---|---|---|---|---|---|
| US-7202265-B2 | Indolinone combinatorial libraries and related products and methods for the treatment of disease | SUGEN, INC. (US) | 2007-04-10 | — | — | US | disclosed |