Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCPS | Q96C86 | 13/20 | 0.47 |
| ▸ | DHFR | P00374 | 2/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.39 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL6015541 | 0.90 | DCPS (0.59) | DCPSDHFRCYP2D6IKBKB | |
| SCHEMBL6015552 | 0.85 | DCPS (0.54) | DCPSDHFRCYP2D6IKBKB | |
| SCHEMBL6015537 | 0.80 | HRH1 (0.43) | DCPSDHFR | |
| SCHEMBL1155228 | 0.79 | DCPS (0.74) | DCPSDHFRCYP2D6 | |
| SCHEMBL12322611 | 0.79 | MCHR1 (0.43) | MCHR1AVPR2AVPR1A | |
| Hydrochloric Acid SCHEMBL2416883 | 0.78 | MCHR1 (0.42) | MCHR1AVPR2AVPR1A | |
| Hydrochloric Acid SCHEMBL1154677 | 0.78 | DCPS (0.72) | DCPSDHFRCYP2D6 | |
| SCHEMBL5219977 | 0.77 | DCPS (0.61) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL4003593 | 0.76 | DCPS (0.60) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL6015539 | 0.76 | CHRNB2 (0.51) | DCPSDHFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012054526-A2 | CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES | ELCELYX THERAPEUTICS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |