Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CPA3 | P15088 | 1/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9531756 | 0.91 | SLC6A2 (0.50) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL19354261 | 0.85 | IDO1 (0.43) | CYP1A2EPHX1CPA3FOLH1IDO1 | |
| SCHEMBL19354535 | 0.85 | IDO1 (0.43) | CYP1A2EPHX1CPA3FOLH1IDO1 | |
| SCHEMBL7448082 | 0.84 | SLC6A2 (0.40) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL6785583 | 0.83 | CYP1A2 (0.54) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL2093344 | 0.83 | CYP1A2 (0.39) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL7507014 | 0.83 | CYP1A2 (0.54) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| Hydrochloric Acid SCHEMBL6791172 | 0.82 | CYP1A2 (0.53) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL5641607 | 0.80 | CYP1A2 (0.41) | CYP1A2SLC6A2SLC6A4SLC6A3EPHX1 | |
| SCHEMBL7438313 | 0.80 | SLC6A2 (0.40) | CYP1A2SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4142029-A | Bis-tetrazoles as chemical blowing agents for foaming thermoplastic resins | CIBA-GEIGY CORPORATION (US) | 1979-02-27 | — | — | US | disclosed |