Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 6/20 | 0.48 |
| ▸ | CASP2 | P42575 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 7/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 6/20 | 0.41 |
| ▸ | PPARD | Q03181 | 6/20 | 0.41 |
| ▸ | PPARA | Q07869 | 6/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TLR2 | O60603 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | FABP4 | P15090 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.41 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6126649 | 1.00 | EPHX1 (0.48) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL3793778 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419860 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419777 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL15540147 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL25410196 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419942 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419944 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419594 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 | |
| SCHEMBL1419635 | 0.94 | EPHX1 (0.47) | EPHX1CASP2HDAC1HDAC3HDAC2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117222646-A | KRAS G12C inhibitors and uses thereof | 苏州赞荣医药科技有限公司 | 2023-12-12 | — | — | CN | disclosed |