Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 9/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 8/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9372184 | 0.88 | HTR2A (0.42) | HTR1AMTNR1BMTNR1AHTR2ACYP2D6 | |
| SCHEMBL8900865 | 0.79 | TAS1R3 (0.43) | HTR1AGAAKMT2AMTNR1BMTNR1A | |
| SCHEMBL7926754 | 0.78 | HTR1A (0.55) | HTR1AHTR2A | |
| SCHEMBL7935755 | 0.78 | HTR1A (0.52) | HTR1AKMT2AMTNR1BMTNR1ACYP1A2 | |
| SCHEMBL8168722 | 0.78 | EGFR (0.48) | GAAKMT2AHTR2ACYP2D6CYP1A2 | |
| SCHEMBL7926523 | 0.77 | HTR1A (0.53) | HTR1AHTR2A | |
| SCHEMBL7935873 | 0.76 | MTNR1A (0.43) | HTR1AKMT2AMTNR1BMTNR1ACYP2D6 | |
| SCHEMBL9052842 | 0.74 | DRD2 (0.45) | HTR1A | |
| SCHEMBL9441175 | 0.73 | MTNR1B (0.44) | HTR1AMTNR1BMTNR1AHTR2A | |
| SCHEMBL10394822 | 0.73 | MTNR1B (0.51) | HTR1AMTNR1BMTNR1ACYP1A2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0482084-B1 | (1,2N) AND (3,2N)-CARBOCYCLIC-2-AMINO TETRALIN DERIVATIVES | UPJOHN CO (US) | 1997-05-07 | — | — | EP | disclosed |
| US-5491236-A | NERVOUS SYTEM DISORDERS | THE UPJOHN COMPANY (US) | 1996-02-13 | — | — | US | disclosed |