Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.57 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.57 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.57 |
| ▸ | ABL1 | P00519 | 9/20 | 0.54 |
| ▸ | BCR | P11274 | 8/20 | 0.54 |
| ▸ | EGFR | P00533 | 3/20 | 0.54 |
| ▸ | SRC | P12931 | 2/20 | 0.54 |
| ▸ | PRKACA | P17612 | 1/20 | 0.54 |
| ▸ | PRKACG | P22612 | 1/20 | 0.54 |
| ▸ | PRKACB | P22694 | 1/20 | 0.54 |
| ▸ | ABL2 | P42684 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.46 |
| ▸ | AXL | P30530 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | PRKCA | P17252 | 4/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30921140 | 1.00 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1PTK2ABL1BCR | |
| SCHEMBL22206280 | 0.86 | ABL1 (0.63) | HSP90AA1HSP90AB1PTK2ABL1BCR | |
| Ammonia Solution, Strong SCHEMBL2693849 | 0.85 | ABL1 (0.62) | HSP90AA1HSP90AB1PTK2ABL1BCR | |
| Hydrochloric Acid SCHEMBL5531500 | 0.84 | ABL1 (0.61) | HSP90AA1HSP90AB1PTK2ABL1BCR | |
| SCHEMBL7476653 | 0.82 | ABL1 (0.48) | HSP90AA1ABL1BCREGFRSRC | |
| SCHEMBL145074 | 0.80 | AXL (0.59) | MEN1PSIP1AXLMKNK1MKNK2 | |
| Hydrochloric Acid SCHEMBL6739740 | 0.79 | AXL (0.58) | MEN1PSIP1AXLMKNK1MKNK2 | |
| Hydrochloric Acid SCHEMBL7090061 | 0.79 | AXL (0.58) | MEN1PSIP1AXLMKNK1MKNK2 | |
| SCHEMBL207818 | 0.77 | CYP19A1 (0.64) | AXLMKNK1MKNK2MAPTCYP19A1 | |
| SCHEMBL1231783 | 0.77 | HSP90AA1 (0.64) | HSP90AA1HSP90AB1PTK2ABL1BCR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0233461-B2 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 2002-05-29 | — | — | EP | disclosed |
| EP-0233461-B1 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 1996-03-20 | — | — | EP | disclosed |