Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MAT2A | P31153 | 4/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13480380 | 1.00 | ESR2 (0.47) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL14924284 | 0.95 | ESR2 (0.52) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL9061943 | 0.90 | ESR2 (0.47) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL9061934 | 0.90 | ESR2 (0.47) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL8766989 | 0.87 | IDO1 (0.42) | IDO1LMNAALDH1A1L3MBTL1MAT2A | |
| SCHEMBL9060751 | 0.86 | ACACB (0.44) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL9061110 | 0.86 | ESR2 (0.44) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL9061115 | 0.86 | ESR2 (0.44) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL14228593 | 0.86 | LMNA (0.39) | ESR2IDO1LMNAALDH1A1L3MBTL1 | |
| SCHEMBL9062362 | 0.86 | ESR2 (0.44) | ESR2IDO1LMNAALDH1A1HRH3 |
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-5536442-A | ELECTROOPTICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-16 | — | — | US | disclosed |
| EP-0381728-B1 | DIFLUOROMETHYL COMPOUNDS | MERCK PATENT GMBH (DE) | 1993-12-08 | — | — | EP | disclosed |