Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | HTR1E | P28566 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4660218 | 1.00 | IMPDH2 (0.47) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL27938029 | 0.83 | CYP2A6 (0.50) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL7192679 | 0.80 | ATM (0.50) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL17232880 | 0.80 | ATM (0.50) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL27719419 | 0.80 | CYP2A6 (0.47) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL14694211 | 0.78 | ATM (0.50) | IMPDH2CYP2A6ATMALDH1A1IMPDH1 | |
| Hydrochloric Acid SCHEMBL8129884 | 0.76 | CYP2A6 (0.44) | IMPDH2CYP2A6ATMALDH1A1HPGD | |
| SCHEMBL13335152 | 0.76 | ATM (0.54) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL30437029 | 0.76 | ATM (0.54) | IMPDH2CYP2A6ATMALDH1A1PBRM1 | |
| SCHEMBL1685393 | 0.76 | ATM (0.54) | IMPDH2CYP2A6ATMALDH1A1PBRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4719199-A | VASORPRESSIN ANTAGONIST | SMITHKLINE BECKMAN CORPORATION (US) | 1988-01-12 | — | — | US | disclosed |
| US-4684716-A | VASOPRESSIN ANTAGONISTS | SMITHKLINE BECKMAN CORPORATION (US) | 1987-08-04 | — | — | US | disclosed |
| US-4597901-A | POLYPEPTIDES, DIURESIS | SMITHKLINE BECKMAN CORPORATION (US) | 1986-07-01 | — | — | US | disclosed |