Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2273980 | 0.87 | DRD2 (0.46) | OPRM1HDAC4L3MBTL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8809179 | 0.87 | CYP17A1 (0.40) | OPRM1HDAC1TACR1TSHRALOX15 | |
| SCHEMBL8808902 | 0.86 | ITGA4 (0.47) | OPRM1HDAC1TACR1TSHRALOX15 | |
| SCHEMBL8806582 | 0.86 | HDAC1 (0.41) | OPRM1HDAC1TACR1 | |
| SCHEMBL8808488 | 0.82 | AKT1 (0.37) | OPRM1ALDH1A1HTTAKT1 | |
| SCHEMBL3892253 | 0.80 | OPRM1 (0.45) | OPRM1HDAC1TACR1TSHRALOX15 | |
| SCHEMBL6216344 | 0.80 | OPRM1 (0.55) | OPRM1HDAC1TACR1TSHRALOX15 | |
| SCHEMBL15200870 | 0.79 | OPRM1 (0.54) | OPRM1HDAC1TACR1HDAC4ROCK2 | |
| Hydrochloric Acid SCHEMBL27552695 | 0.78 | OPRM1 (0.44) | OPRM1HDAC1TACR1TSHRALOX15 | |
| SCHEMBL6544545 | 0.77 | OPRM1 (0.57) | OPRM1HDAC1TACR1HDAC4ROCK2 |
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-0696280-B1 | SUBSTITUTED PYRROLIDIN-3-YL-ALKYL-PIPERIDINES USEFUL AS TACHYKININ ANTAGONISTS | MERRELL PHARMA INC (US) | 1997-09-24 | — | — | EP | disclosed |