Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | AHR | P35869 | 1/20 | 0.55 |
| ▸ | RAD52 | P43351 | 1/20 | 0.55 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.55 |
| ▸ | TERT | O14746 | 1/20 | 0.54 |
| ▸ | HRH1 | P35367 | 3/20 | 0.53 |
| ▸ | DRD2 | P14416 | 3/20 | 0.53 |
| ▸ | HTR6 | P50406 | 3/20 | 0.53 |
| ▸ | HTR1A | P08908 | 2/20 | 0.53 |
| ▸ | HTR2A | P28223 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | STAT3 | P40763 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11734596 | 0.92 | MAOB (0.53) | KMT2ACYP1A2CYP2D6POLBNR1I2 | |
| SCHEMBL11734544 | 0.86 | MAOB (0.55) | KMT2ACYP1A2ADRA1ACYP3A4TSHR | |
| SCHEMBL11737697 | 0.86 | MAOB (0.51) | KMT2ACYP1A2HRH1DRD2HTR6 | |
| SCHEMBL11640507 | 0.84 | POLB (0.52) | KMT2ACYP1A2CYP2D6POLBNR1I2 | |
| SCHEMBL11741242 | 0.83 | MAOB (0.62) | MAOB | |
| SCHEMBL11739072 | 0.83 | ACHE (0.47) | CYP1A2ADRA1ACYP3A4TSHRADRA2B | |
| SCHEMBL11737347 | 0.83 | CYP1A2 (0.53) | KMT2ACYP1A2ADRA1ACYP3A4TSHR | |
| SCHEMBL11640552 | 0.83 | CYP2D6 (0.78) | KMT2ACYP1A2CYP2D6POLBNR1I2 | |
| SCHEMBL11735581 | 0.82 | MAOB (0.51) | CYP1A2ADRA1ACYP3A4TSHRADRA2B | |
| SCHEMBL11738541 | 0.82 | MAOB (0.44) | KMT2ACYP1A2CYP2D6HRH1ADRA1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3947451-A | TREATMENT OF PSYCHIATRIC AND PSYCHOSOMATIC DISEASES | AB KABI (SW) | 1976-03-30 | — | — | US | claimed |
| US-4123543-A | ANTIDEPRESSANTS | AB KABI (SE) | 1978-10-31 | — | — | US | disclosed |
| US-4117144-A | ANTIDEPRESSANTS | AB KABI (SE) | 1978-09-26 | — | — | US | disclosed |
| US-3947451-A | TREATMENT OF PSYCHIATRIC AND PSYCHOSOMATIC DISEASES | AB KABI (SW) | 1976-03-30 | — | — | US | disclosed |