Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | CASP1 | P29466 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.62 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | RARB | P10826 | 8/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7584187 | 0.98 | CYP3A4 (0.64) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL13785249 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL10980724 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL20437099 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL4084301 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL8375389 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL19756376 | 0.95 | CYP3A4 (0.65) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL14525744 | 0.95 | CYP3A4 (0.60) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL11384850 | 0.92 | CYP3A4 (0.61) | CYP3A4MEN1ALDH1A1KMT2AUSP2 | |
| SCHEMBL10705995 | 0.91 | CYP3A4 (0.75) | CYP3A4MEN1ALDH1A1KMT2AUSP2 |
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-5093026-A | Liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-03-03 | — | — | US | disclosed |
| EP-0407569-A1 | DIPHENYLETHANES | MERCK PATENT GmbH (DE) | 1991-01-16 | — | — | EP | disclosed |
| WO-1990008756-A1 | DIPHENYLETHANES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-09 | — | — | WO | disclosed |