Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 2/20 | 0.39 |
| ▸ | CCND1 | P24385 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7311376 | 0.86 | LMNA (0.54) | TRPV1SIGMAR1GRIN2BHTR1AADRA1D | |
| SCHEMBL7304705 | 0.72 | SCD (0.34) | HTR1A | |
| SCHEMBL7300850 | 0.66 | MAPT (0.44) | — | |
| SCHEMBL28117214 | 0.64 | HDAC1 (0.58) | SIGMAR1GRIN2BHTR1AHDAC1HDAC6 | |
| SCHEMBL967638 | 0.63 | HDAC1 (0.60) | TRPV1SIGMAR1GRIN2BHTR1AHDAC1 | |
| SCHEMBL7249585 | 0.63 | SIGMAR1 (0.74) | SIGMAR1GRIN2BHTR1A | |
| SCHEMBL28929350 | 0.63 | SIGMAR1 (0.60) | TRPV1SIGMAR1GRIN2BHTR1AHDAC1 | |
| Trifluoroacetic Acid SCHEMBL7658811 | 0.63 | HTR1A (0.53) | SIGMAR1GRIN2BHTR1AHDAC1HDAC6 | |
| SCHEMBL1415530 | 0.63 | HTR1A (0.81) | SIGMAR1GRIN2BHTR1A | |
| SCHEMBL22213679 | 0.63 | SIGMAR1 (0.56) | SIGMAR1GRIN2BHTR1A |
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-0666260-B1 | 3-(2-aminoethyl)-4-3-(trifluoromethyl)benzoyl-3,4-dihydro-2H-1,4-benzoxazine derivatives, their preparation and use in therapy | SYNTHELABO (FR) | 1999-08-04 | — | — | EP | disclosed |
| EP-0666260-A1 | 3-(2-aminoethyl)-4-3-(trifluoromethyl)benzoyl-3,4-dihydro-2H-1,4-benzoxazine derivatives, their preparation and use in therapy | SYNTHELABO (FR) | 1995-08-09 | — | — | EP | disclosed |