Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | CNR1 | P21554 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 3/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.49 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.47 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.47 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.47 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28654800 | 0.98 | HTT (0.54) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL13995332 | 0.86 | MEN1 (0.53) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL11621292 | 0.84 | IDO1 (0.65) | CNR1IDO1GPR84MAPK1CYP1A2 | |
| SCHEMBL6894441 | 0.83 | CNR1 (0.51) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL680436 | 0.83 | TAAR1 (0.60) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL2856783 | 0.83 | CNR1 (0.51) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL5405695 | 0.82 | TAAR1 (0.59) | TAAR1CNR1GPR84ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL20529751 | 0.82 | MAPK1 (0.52) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL5099392 | 0.81 | SIGMAR1 (0.47) | TAAR1CNR1IDO1GPR84MAPK1 | |
| SCHEMBL31439249 | 0.81 | PLA2G1B (0.55) | TAAR1CNR1GPR84ALDH1A1HPGD |
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-113735715-A | Bis (2, 4-dichlorophenethyl) amine hydrochloride and preparation method thereof | 山东金城柯瑞化学有限公司 | 2021-12-03 | — | — | CN | disclosed |