Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7987352 | 0.79 | LCK (0.47) | NQO2PTGS1PTGS2CYP1A2PIM1 | |
| SCHEMBL9372014 | 0.78 | NFE2L2 (0.44) | NQO2PTGS1RXRA | |
| SCHEMBL7980865 | 0.75 | LCK (0.46) | — | |
| SCHEMBL8072577 | 0.73 | MAOA (0.49) | CYP1A2AHRPIM1PIM2 | |
| SCHEMBL30692069 | 0.71 | CES2 (0.58) | CYP1A2 | |
| SCHEMBL29153446 | 0.71 | CES2 (0.58) | CYP1A2 | |
| SCHEMBL29153447 | 0.71 | CES2 (0.58) | CYP1A2 | |
| SCHEMBL4264937 | 0.70 | NQO2 (1.00) | NQO2PTGS1PTGS2CYP1A2AHR | |
| SCHEMBL4264940 | 0.70 | NQO2 (1.00) | NQO2PTGS1PTGS2CYP1A2AHR | |
| SCHEMBL4157456 | 0.70 | CYP19A1 (0.46) | CYP1A2PIM1PIM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6194439-B1 | ANTICANCER AGENT | PFIZER INC. | 2001-02-27 | — | — | US | disclosed |
| EP-0586608-A1 | TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS | PFIZER INC. (US) | 1994-03-16 | — | — | EP | disclosed |
| WO-1992021660-A1 | TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS | PFIZER, INC. (US) | 1992-12-10 | — | — | WO | disclosed |