Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL597056 | 0.80 | CYP2A6 (0.45) | NOS2NOS3MAPTCYP1A2ALDH1A1 | |
| SCHEMBL29066277 | 0.72 | IDO1 (0.42) | MAOAMAOBMAPTLMNACYP1A2 | |
| SCHEMBL19657536 | 0.71 | SLC6A4 (0.42) | MAOAMAOBMAPTCYP1A2HTT | |
| SCHEMBL30417664 | 0.70 | CD44 (0.52) | NOS2NOS3CYP1A2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL31409223 | 0.70 | CYP3A4 (0.44) | MAOAMAOBMAPTLMNACYP1A2 | |
| SCHEMBL6344760 | 0.70 | CD44 (0.52) | NOS2NOS3CYP1A2ALDH1A1CYP3A4 | |
| Methylamine SCHEMBL27931104 | 0.70 | GABRA1 (0.46) | NOS2NOS3CYP1A2CYP3A4HTR1A | |
| SCHEMBL31975 | 0.69 | — | — | |
| SCHEMBL14688683 | 0.68 | TSHR (0.51) | ALDH1A1HTTNPC1TSHRRAB9A | |
| SCHEMBL5250399 | 0.67 | TAAR1 (0.50) | MAPTCYP1A2ALDH1A1HTTTSHR |
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-4088771-A | 1-Lower alkyl-4,5-dihydro-5-phenyl-2-lower alkoxy carbonylaminoimidazoles and substituted phenyl derivatives thereof | SYNTEX (U.S.A.) INC. (US) | 1978-05-09 | — | — | US | disclosed |