Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL8200225 | 0.98 | MCHR1 (0.49) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL3067135 | 0.92 | RIPK1 (0.53) | MCHR1HTR2CRIPK1 | |
| SCHEMBL1340888 | 0.78 | MCHR1 (0.55) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL77714 | 0.78 | GAA (0.52) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL8224255 | 0.78 | LMNA (0.51) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL24224814 | 0.78 | ALDH1A1 (0.61) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL34475634 | 0.76 | MCHR1 (0.49) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL5673940 | 0.76 | ALDH1A1 (0.59) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL28729860 | 0.76 | MCHR1 (0.49) | MCHR1HTR2CRIPK1CNR1CNR2 | |
| SCHEMBL5777914 | 0.76 | LMNA (0.50) | MCHR1HTR2CRIPK1CNR1CNR2 |
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-6972296-B2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC. (US) | 2005-12-06 | — | — | US | disclosed |