Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 2/20 | 0.36 |
| ▸ | GOT1 | P17174 | 1/20 | 0.36 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.36 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.32 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25329754 | 0.76 | ALDH1A1 (0.37) | ALDH1A1SLC6A2MEN1TSHRKMT2A | |
| SCHEMBL29073451 | 0.73 | SLC6A2 (0.52) | AADATGOT1KYAT1KYAT3SLC6A2 | |
| SCHEMBL29073300 | 0.71 | OPRM1 (0.44) | AADATGOT1KYAT1KYAT3ALDH1A1 | |
| SCHEMBL3053165 | 0.68 | MEN1 (0.46) | ALDH1A1GAAMEN1KMT2ACYP1A2 | |
| SCHEMBL15956944 | 0.62 | PSEN1 (0.41) | ALDH1A1MEN1KMT2ARAB9ACYP3A4 | |
| SCHEMBL29073421 | 0.61 | BRD4 (0.44) | GAA | |
| SCHEMBL28016432 | 0.60 | IDO1 (0.63) | ALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL2175357 | 0.59 | IDO1 (0.61) | AVPR1A | |
| SCHEMBL5362433 | 0.59 | TBXAS1 (0.33) | AADATALDH1A1MEN1KMT2A | |
| SCHEMBL30685660 | 0.58 | IDO1 (0.54) | — |
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-116783165-A | 1,2,3, 4-tetrahydroquinoline derivatives as YAP/TAZ-TEAD activation inhibitors for the treatment of cancer | 天主教鲁汶大学 | 2023-09-19 | — | — | CN | disclosed |