Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 14/20 | 0.64 |
| ▸ | BCR | P11274 | 13/20 | 0.64 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5923911 | 0.89 | TRPV1 (0.56) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL15533534 | 0.87 | THRB (0.58) | ABL1BCRTRPV1LMNABACE1 | |
| SCHEMBL15533631 | 0.86 | ABL1 (0.46) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL15533950 | 0.85 | ABL1 (0.47) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL1013728 | 0.81 | ABL1 (0.76) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL1013630 | 0.80 | ABL1 (0.62) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL15533765 | 0.79 | ABL1 (0.57) | ABL1BCRUSP2ALDH1A1CYP1A2 | |
| SCHEMBL15534052 | 0.79 | EGFR (0.55) | TRPV1USP2ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL4832960 | 0.79 | ABL1 (0.72) | ABL1BCRTRPV1USP2ALDH1A1 | |
| SCHEMBL15534046 | 0.79 | ABL1 (0.68) | ABL1BCRTRPV1USP2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | claimed |
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | disclosed |