Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.61 |
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.56 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | CCR3 | P51677 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10969939 | 0.86 | HTR2A (0.54) | SIGMAR1HTR2AOPRM1OPRD1OPRK1 | |
| SCHEMBL7276778 | 0.85 | SIGMAR1 (0.54) | SIGMAR1HTR2AOPRM1OPRD1ACHE | |
| SCHEMBL13266074 | 0.84 | ALDH1A1 (0.64) | HTR2AOPRM1OPRK1HTR2CHTR2B | |
| SCHEMBL27474479 | 0.81 | TP53 (0.50) | — | |
| SCHEMBL15147383 | 0.79 | CHRM3 (0.60) | — | |
| SCHEMBL10874959 | 0.79 | STS (0.48) | — | |
| SCHEMBL15147380 | 0.79 | CHRM3 (0.60) | — | |
| SCHEMBL6761969 | 0.79 | CYP19A1 (0.66) | — | |
| SCHEMBL5049441 | 0.79 | CYP19A1 (0.71) | — | |
| SCHEMBL5709472 | 0.77 | HTR2A (0.50) | SIGMAR1HTR2AACHE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150196522-A1 | METHODS OF USING (1S,3S)-3-AMINO-4-DIFLUOROMETHYLENYL-1-CYCLOPENTANOIC ACID | NORTHWESTERN UNIVERSITY | 2015-07-16 | — | — | US | disclosed |
| US-8969413-B2 | Methods of using (1S,3S)-3-amino-4-difluoromethylenyl-1-cyclopentanoic acid | CATALYST PHARMACEUTICAL PARTNERS (US) | 2015-03-03 | — | — | US | disclosed |
| US-20130041028-A1 | METHODS OF USING (1S,3S)-3-AMINO-4-DIFLUOROMETHYLENYL-1-CYCLOPENTANOIC ACID | NORTHWESTERN UNIVERSITY (US) | 2013-02-14 | — | — | US | disclosed |
| EP-2542234-A2 | METHODS OF USING (1S, 3S) -3-AMINO-4-DIFLUOROMETHYLENYL-1-CYCLOPENTANOIC ACID | North Western University (US) | 2013-01-09 | — | — | EP | disclosed |
| WO-2011106692-A2 | METHODS OF USING (1S, 3S) -3-AMINO-4-DIFLUOROMETHYLENYL-1-CYCLOPENTANOIC ACID | NORTHWESTERN UNIVERSITY (US) | 2011-09-01 | — | — | WO | disclosed |