Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | PRKCG | P05129 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | LYN | P07948 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 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 | |
|---|---|---|---|---|
| SCHEMBL2282586 | 0.77 | TAAR1 (0.59) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL770786 | 0.69 | ADRA2A (0.56) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL28046710 | 0.67 | ADRA2A (0.55) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL28046796 | 0.67 | ADRA2A (0.55) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL28046706 | 0.67 | ADRA2A (0.55) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL15380931 | 0.67 | MEN1 (0.42) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL6906114 | 0.67 | POLB (0.46) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL3439834 | 0.66 | VSIR (0.52) | POLBTAAR1MEN1KMT2AGAA | |
| SCHEMBL2231249 | 0.65 | POLB (0.44) | POLBTAAR1MEN1KMT2AGAA | |
| Diphenylamine SCHEMBL28100989 | 0.64 | HSD17B10 (0.75) | POLBMEN1KMT2AGAAMAPT |
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-113501808-B | Sulfinyl anilino pyrimidine derivative and application thereof in preparation of antitumor drugs | 清远中大创新药物研究中心 | 2024-06-11 | — | — | CN | disclosed |
| CN-113501808-B | Sulfinyl anilino pyrimidine derivative and application thereof in preparation of antitumor drugs | 清远中大创新药物研究中心 | 2024-06-11 | — | — | CN | disclosed |
| CN-113501808-B | Sulfinyl anilino pyrimidine derivative and application thereof in preparation of antitumor drugs | 清远中大创新药物研究中心 | 2024-06-11 | — | — | CN | disclosed |
| CN-113501808-A | Novel pyrimidine derivative of sulfinyl anilino and application of novel pyrimidine derivative in preparation of antitumor drugs | 清远中大创新药物研究中心 | 2021-10-15 | — | — | CN | disclosed |
| EP-0053693-A1 | Penicillins, their salts, process for their preparation and pharmaceutical compositions containing them | Dr. Karl Thomae GmbH (DE) | 1982-06-16 | — | — | EP | disclosed |