Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | F2R | P25116 | 1/20 | 0.33 |
| ▸ | RHOA | P61586 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 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 | |
|---|---|---|---|---|
| SCHEMBL6410747 | 1.00 | TACR1 (0.37) | TACR1POLBTSHRGAAHTT | |
| SCHEMBL6410751 | 1.00 | TACR1 (0.37) | TACR1POLBTSHRGAAHTT | |
| SCHEMBL6417610 | 0.85 | LMNA (0.51) | TACR1POLBHTTALDH1A1LMNA | |
| SCHEMBL6411515 | 0.79 | TSHR (0.40) | TACR1TSHRGAAHTTLMNA | |
| SCHEMBL6410860 | 0.78 | TACR1 (0.38) | TACR1ALDH1A1 | |
| SCHEMBL6410861 | 0.78 | TACR1 (0.38) | TACR1ALDH1A1 | |
| SCHEMBL6664525 | 0.78 | TACR1 (0.38) | TACR1ALDH1A1 | |
| SCHEMBL6414378 | 0.78 | CYP2C19 (0.41) | TACR1CYP2C19 | |
| SCHEMBL6418985 | 0.77 | TACR1 (0.44) | TACR1ALDH1A1LMNA | |
| SCHEMBL6415621 | 0.76 | P2RX7 (0.39) | TACR1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004004727-A1 | 3,4-DIHYDROISOQUINOLIN-1-ONE DERIVATIVES AS INDUCERS OF APOPTOSIS | AXYS PHARMACEUTICALS, INC. (US) | 2004-01-15 | — | — | WO | disclosed |