Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.52 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8861643 | 0.94 | HRH4 (0.59) | HRH4ACERAB9ANPC1CYP3A4 | |
| SCHEMBL8861644 | 0.94 | HRH4 (0.59) | HRH4ACERAB9ANPC1CYP3A4 | |
| SCHEMBL8861720 | 0.90 | HRH4 (0.44) | HRH4ACERAB9ANPC1POLB | |
| SCHEMBL8861636 | 0.82 | CYP1A2 (0.40) | HRH4ACEPOLBCYP1A2CYP3A4 | |
| SCHEMBL8861564 | 0.82 | HRH4 (0.39) | HRH4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL8861616 | 0.82 | CYP1A2 (0.45) | ACECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8861686 | 0.82 | CYP1A2 (0.45) | ACECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8861602 | 0.81 | CYP2D6 (0.42) | HRH4RAB9APOLBCYP1A2CYP3A4 | |
| SCHEMBL8861589 | 0.80 | CYP1A2 (0.41) | HRH4ACECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8861622 | 0.79 | CYP1A2 (0.45) | ACECYP1A2CYP3A4CYP2D6CYP2C9 |
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-5599951-A | ENZYME INHIBITORS | SOCIETE CIVILE BIOPROJET (FR) | 1997-02-04 | — | — | US | disclosed |