Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 5/20 | 0.49 |
| ▸ | TACR1 | P25103 | 5/20 | 0.49 |
| ▸ | TACR3 | P29371 | 1/20 | 0.49 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 4/20 | 0.36 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | CCRL2 | O00421 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL296856 | 0.86 | TACR2 (0.64) | TACR2TACR1TACR3CTSSKCNH2 | |
| SCHEMBL923115 | 0.80 | TACR2 (0.46) | TACR2TACR1TACR3CTSSVNN1 | |
| SCHEMBL297161 | 0.76 | TACR2 (0.61) | TACR2TACR1TACR3CTSSKCNH2 | |
| SCHEMBL296764 | 0.74 | TACR2 (0.57) | TACR2TACR1TACR3CTSSKCNH2 | |
| SCHEMBL296965 | 0.73 | TACR2 (0.61) | TACR2TACR1TACR3CTSSKCNH2 | |
| SCHEMBL295192 | 0.72 | TACR1 (0.55) | TACR2TACR1TACR3CTSS | |
| SCHEMBL297516 | 0.72 | TACR1 (0.55) | TACR2TACR1TACR3CTSS | |
| SCHEMBL296901 | 0.72 | TACR1 (0.55) | TACR2TACR1TACR3CTSS | |
| SCHEMBL296893 | 0.72 | TACR2 (0.83) | TACR2TACR1TACR3 | |
| SCHEMBL297588 | 0.72 | TACR1 (0.54) | TACR2TACR1TACR3CTSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-2200982-B1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2012-03-14 | — | — | EP | disclosed |