Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | STK39 | Q9UEW8 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL8500221 | 0.88 | MCL1 (0.35) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL8501375 | 0.88 | PPARG (0.41) | ALDH1A1KDM4ENPBWR1MEN1KMT2A | |
| SCHEMBL8500430 | 0.83 | PPARG (0.39) | AKR1C3AKR1C2KMT2APPARGPPARA | |
| SCHEMBL8499012 | 0.83 | NPBWR1 (0.40) | ALDH1A1KDM4ENPBWR1ERN1PTGS2 | |
| SCHEMBL8496759 | 0.82 | ALDH1A1 (0.39) | AKR1C3ALDH1A1KDM4ENPBWR1ERN1 | |
| SCHEMBL7182545 | 0.81 | ESR1 (0.52) | ALDH1A1KDM4E | |
| SCHEMBL7182554 | 0.81 | ESR1 (0.52) | ALDH1A1KDM4E | |
| SCHEMBL8499729 | 0.81 | ESR1 (0.42) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL8500328 | 0.81 | AKR1C3 (0.42) | AKR1C3AKR1C2ALDH1A1KDM4EPTGS2 | |
| SCHEMBL7184010 | 0.80 | ESR1 (0.43) | ALDH1A1KDM4ENPBWR1ERN1PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5916916-A | USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. | ELI LILLY AND COMPANY (US) | 1999-06-29 | — | — | US | claimed |
| US-5916916-A | USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. | ELI LILLY AND COMPANY (US) | 1999-06-29 | — | — | US | disclosed |