Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 5/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.46 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL8310519 | 0.83 | NQO2 (0.46) | MTNR1AMTNR1BNQO2ADRB2AKR1C3 | |
| Hydrochloric Acid SCHEMBL8912255 | 0.82 | NQO2 (0.45) | MTNR1AMTNR1BNQO2ADRB2AKR1C3 | |
| SCHEMBL8307225 | 0.79 | NQO2 (0.47) | MTNR1AMTNR1BNQO2ADRB2AKR1C3 | |
| Hydrochloric Acid SCHEMBL8913070 | 0.79 | NQO2 (0.46) | MTNR1AMTNR1BNQO2ADRB2AKR1C3 | |
| SCHEMBL31670925 | 0.69 | HTR1B (0.63) | MTNR1AMTNR1BNQO2ADRB2HTR6 | |
| SCHEMBL8304470 | 0.68 | ADRB2 (0.70) | MTNR1AMTNR1BNQO2ADRB2HTR6 | |
| SCHEMBL11343620 | 0.68 | KDM2B (0.52) | ALDH1A1KDM4ECYP3A4CYP2D6 | |
| SCHEMBL11521240 | 0.67 | AKR1C3 (0.56) | AKR1C3LMNAAKR1C2CYP2D6 | |
| SCHEMBL8306860 | 0.67 | HTR1A (0.62) | — | |
| SCHEMBL18509701 | 0.66 | MTNR1A (0.67) | MTNR1AMTNR1BNQO2ADRB2HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0747379-A1 | Derivatives of indole, indazole and benzisoxazole for the treatment of schizophrenia | ADIR ET COMPAGNIE (FR) | 1996-12-11 | — | — | EP | disclosed |