Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28528284 | 0.81 | CYP2D6 (0.38) | KMT2ACYP2C9CYP2C19TSHROPRM1 | |
| SCHEMBL28528279 | 0.81 | CYP2D6 (0.38) | KMT2ACYP2C9CYP2C19TSHROPRM1 | |
| SCHEMBL28534879 | 0.80 | OPRM1 (0.39) | ALDH1A1KMT2AOPRM1OPRK1 | |
| SCHEMBL28519576 | 0.77 | NOS1 (0.37) | ALDH1A1GAAKMT2AMAPTOPRM1 | |
| SCHEMBL24775580 | 0.77 | HRH3 (0.38) | CYP2C9CYP2C19MAPTOPRM1OPRK1 | |
| SCHEMBL28535286 | 0.75 | CHRNB2 (0.40) | OPRM1OPRK1 | |
| SCHEMBL31525091 | 0.73 | HTR2C (0.41) | CYP2C9CYP2C19 | |
| SCHEMBL28909558 | 0.73 | HRH3 (0.41) | CYP2C9CYP2C19MAPTOPRM1OPRK1 | |
| SCHEMBL28909552 | 0.73 | HRH3 (0.41) | CYP2C9CYP2C19MAPTOPRM1OPRK1 | |
| SCHEMBL28529792 | 0.73 | HTR2C (0.41) | CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117683029-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-117430601-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-01-23 | — | — | CN | disclosed |
| CN-112437772-B | Bcl-2 inhibitors | 百济神州有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-112437772-A | Bcl-2 inhibitors | 百济神州有限公司 | 2021-03-02 | — | — | CN | disclosed |