Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NT5E | P21589 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22260953 | 0.78 | HTR2A (0.40) | HTR2ALMNAALDH1A1TSHRNT5E | |
| SCHEMBL13097331 | 0.77 | ESR1 (0.50) | LMNAOPRM1OPRL1ALDH1A1CA2 | |
| SCHEMBL11583429 | 0.75 | LMNA (0.56) | HTR2ALMNAALDH1A1TSHRNT5E | |
| SCHEMBL18047763 | 0.74 | LMNA (0.36) | LMNAALDH1A1TSHRNT5ECA2 | |
| SCHEMBL10534447 | 0.74 | HPGD (0.38) | HTR2ALMNAALDH1A1TSHRCA2 | |
| SCHEMBL13097377 | 0.73 | ESR1 (0.50) | LMNAOPRM1OPRL1ALDH1A1CA2 | |
| SCHEMBL6426986 | 0.72 | LMNA (0.37) | LMNAALDH1A1TSHRNT5ECA2 | |
| SCHEMBL30446884 | 0.72 | CA2 (0.57) | LMNAALDH1A1TSHRNT5ECA2 | |
| SCHEMBL5149397 | 0.72 | TAAR1 (0.42) | HTR2AOPRM1OPRL1ALDH1A1HSD11B1 | |
| SCHEMBL92261 | 0.70 | CA2 (0.67) | LMNAALDH1A1TSHRNT5ECA2 |
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-3644991-B1 | 3-(1H-PYRAZOL-4-YL)PYRIDINE ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR | MERCK SHARP & DOHME LLC (US) | 2023-08-02 | — | — | EP | disclosed |