Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 8/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CKS1B | P61024 | 2/20 | 0.34 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.34 |
| ▸ | MRGPRX1 | Q96LB2 | 5/20 | 0.34 |
| ▸ | TSPO | P30536 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29086403 | 1.00 | BRAF (0.40) | BRAFEGLN2KITPTGS1PTGS2 | |
| SCHEMBL25098744 | 0.82 | CYP3A4 (0.32) | BRAFKIT | |
| SCHEMBL16253672 | 0.77 | BRAF (0.42) | BRAFKITPTGS1PTGS2CKS1B | |
| SCHEMBL288456 | 0.76 | CYP2C9 (0.55) | BRAFKITPTGS1PTGS2CKS1B | |
| SCHEMBL29488897 | 0.73 | BRAF (0.40) | BRAFKITPTGS1PTGS2CKS1B | |
| SCHEMBL392180 | 0.73 | GPR119 (0.41) | BRAFEGLN2KIT | |
| SCHEMBL3010599 | 0.72 | BRAF (0.41) | BRAFKITALOX5APFEN1TLR4 | |
| SCHEMBL26812006 | 0.71 | BRAF (0.39) | BRAFKITPTGS1PTGS2CKS1B | |
| SCHEMBL3008478 | 0.71 | BRAF (0.43) | BRAFKITPTGS1PTGS2CKS1B | |
| SCHEMBL28433978 | 0.71 | MAP3K20 (0.58) | BRAFKIT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4232425-A1 | CTPS1 INHIBITORS AND USES THEREOF | Nimbus Clotho, Inc. (US) | 2023-08-30 | — | — | EP | disclosed |
| CN-116601131-A | CTPS1 inhibitor and application thereof | 林伯士克洛索有限公司 | 2023-08-15 | — | — | CN | disclosed |
| WO-2022087634-A1 | CTPS1 INHIBITORS AND USES THEREOF | NIMBUS CLOTHO, INC. (US) | 2022-04-28 | — | — | WO | disclosed |