Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | DCUN1D1 | Q96GG9 | 3/20 | 0.39 |
| ▸ | UBE2M | P61081 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL10989259 | 0.86 | PPARG (0.43) | ALDH1A1KDM4EPPARGPPARAMEN1 | |
| SCHEMBL10996291 | 0.85 | SLC6A9 (0.44) | ALDH1A1KDM4ESLC6A9PPARGPPARA | |
| SCHEMBL10993880 | 0.85 | CARM1 (0.44) | LMNASIGMAR1 | |
| SCHEMBL10989374 | 0.84 | SIGMAR1 (0.47) | SIGMAR1OPRM1OPRL1 | |
| SCHEMBL10994633 | 0.84 | ATM (0.40) | ALDH1A1KDM4EMEN1KMT2ASIGMAR1 | |
| SCHEMBL10987323 | 0.84 | GHSR (0.46) | KDM4ETMEM97SIGMAR1 | |
| SCHEMBL10987479 | 0.84 | TSHR (0.39) | ALDH1A1KDM4ESIGMAR1 | |
| SCHEMBL10993995 | 0.84 | KDM4E (0.40) | ALDH1A1KDM4ESIGMAR1OPRM1 | |
| SCHEMBL10986644 | 0.82 | TSHR (0.38) | ALDH1A1KDM4ESIGMAR1DCUN1D1UBE2M | |
| SCHEMBL12186131 | 0.81 | SLC6A9 (0.70) | ALDH1A1KDM4ESLC6A9PPARGPPARA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4500541-A | Pharmacologically active cyclopropane derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-02-19 | — | — | US | disclosed |
| EP-0039771-B1 | CYCLOPROPANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PRODUCTION | MERCK PATENT GmbH (DE) | 1983-10-19 | — | — | EP | disclosed |
| EP-0039771-A1 | Cyclopropane derivatives, pharmaceutical compositions containing them and processes for their production | MERCK PATENT GmbH (DE) | 1981-11-18 | — | — | EP | disclosed |