Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24717722 | 0.91 | TSHR (0.47) | TSHRCYP3A4CYP2D6PDCD1LG2CD274 | |
| SCHEMBL22564921 | 0.91 | TSHR (0.44) | TSHRCYP3A4CYP2D6ALDH1A1CYP2C9 | |
| SCHEMBL27268957 | 0.88 | TSHR (0.48) | TSHRCYP3A4CYP2D6CYP1A2ALDH1A1 | |
| SCHEMBL25924736 | 0.86 | TSHR (0.57) | TSHRCYP3A4CYP2D6CYP1A2ALDH1A1 | |
| SCHEMBL27268150 | 0.84 | TSHR (0.39) | TSHRCYP3A4CYP2D6CYP1A2ALDH1A1 | |
| SCHEMBL13050540 | 0.84 | TSHR (0.41) | TSHRCYP3A4CYP2D6CYP1A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL484402 | 0.83 | TSHR (0.41) | TSHRCYP3A4CYP2D6CYP1A2ALDH1A1 | |
| SCHEMBL24480651 | 0.83 | NCF1 (0.38) | TSHROPRM1OPRL1NCF1SIGMAR1 | |
| SCHEMBL22564903 | 0.82 | OPRM1 (0.42) | TSHROPRM1OPRL1NCF1EPHX2 | |
| SCHEMBL27290168 | 0.81 | NCF1 (0.39) | TSHROPRM1OPRL1NCF1EPHX2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024112692-A1 | CASITAS B-LINEAGE LYMPHOMA PROTOONCOGENE B (CBL-B) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE | ARVINAS OPERATIONS, INC. (US) | 2024-05-30 | — | — | WO | disclosed |
| WO-2023109892-A1 | COMPOUND FOR INHIBITING OR DEGRADING BRD9, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF | 海思科医药集团股份有限公司 | 2023-06-22 | — | — | WO | disclosed |