Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1634220 | 0.81 | CYP1A2 (0.41) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL4764571 | 0.77 | APLNR (0.36) | — | |
| SCHEMBL29971961 | 0.76 | ALDH1A1 (0.47) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL30915428 | 0.76 | GRIN2D (0.47) | CYP1A2ALDH1A1HRH3HRH1LMNA | |
| SCHEMBL19193695 | 0.76 | CYP1A2 (0.50) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL14214472 | 0.76 | CYP1A2 (0.53) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL30201139 | 0.75 | CYP1A2 (0.61) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL574013 | 0.75 | CYP1A2 (0.61) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 | |
| SCHEMBL10361551 | 0.74 | SYK (0.43) | ALDH1A1HRH3HRH1LMNATAAR1 | |
| SCHEMBL10771160 | 0.72 | HRH1 (0.57) | CYP1A2ALDH1A1CYP2C19HRH3HRH1 |
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-5763461-A | ANTIPICORNAVIRAL AGENTS | SANOFI (FR) | 1998-06-09 | — | — | US | disclosed |
| US-5618821-A | VIRICIDES, PICORNAVIRUS | SANOFI, S.A. (FR) | 1997-04-08 | — | — | US | disclosed |
| WO-1995031438-A1 | THERAPEUTIC PHENOXYALKYLHETEROCYCLES | SANOFI WINTHROP, INC. (US) | 1995-11-23 | — | — | WO | disclosed |