Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 8/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL905244 | 0.85 | ALDH1A1 (0.63) | TSHRGAAMAPTHSD17B10ALDH1A1 | |
| Bicarbonate SCHEMBL27492793 | 0.84 | ALDH1A1 (0.62) | TSHRGAAMAPTHSD17B10ALDH1A1 | |
| SCHEMBL5232709 | 0.81 | ALDH1A1 (0.63) | GAAMAPTALDH1A1KDM4EKMT2A | |
| SCHEMBL5233294 | 0.80 | ALDH1A1 (0.56) | TSHRGAAMAPTHSD17B10MAPK1 | |
| SCHEMBL25720417 | 0.80 | ALDH1A1 (0.54) | TSHRGAAMAPTHSD17B10ALDH1A1 | |
| SCHEMBL14252958 | 0.79 | KDM4E (0.74) | TSHRGAAMAPTHSD17B10MAPK1 | |
| SCHEMBL5738843 | 0.79 | MEN1 (0.49) | TSHRMAPTALDH1A1KDM4EKMT2A | |
| SCHEMBL6580082 | 0.78 | BCL2 (0.50) | MAPTALDH1A1KDM4EKMT2AL3MBTL1 | |
| SCHEMBL19843863 | 0.78 | ALDH1A1 (0.54) | TSHRGAAMAPTHSD17B10ALDH1A1 | |
| SCHEMBL28903966 | 0.78 | CAPN1 (0.52) | TSHRGAAMAPTALDH1A1KMT2A |
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-1065244-C | Tricyclic benzazepine vasopressin antagonists | AMERICAN CYANAMID CO (US) | 2001-05-02 | — | — | CN | disclosed |