Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CRHBP | P24387 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27544440 | 0.81 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL3089786 | 0.81 | ADORA2A (0.56) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL3089781 | 0.81 | ADORA2A (0.56) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL5329331 | 0.80 | ADORA1 (0.56) | ADORA1ADORA2ACDK2HSD17B10 | |
| SCHEMBL17971409 | 0.80 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL16681058 | 0.80 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL3205196 | 0.80 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL12612051 | 0.78 | — | — | |
| SCHEMBL2977679 | 0.76 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL2977681 | 0.76 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2AL3MBTL1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020146636-A1 | COMPOUNDS AND METHODS FOR TREATING OR PREVENTING HEART FAILURE | DREXEL UNIVERSITY (US) | 2020-07-16 | — | — | WO | disclosed |
| US-6603007-B1 | Intermediates in the fields of pharmaceuticals, agrichemicals, ligands, silver halide photosensitive materials, liquid crystals, surfactants, electrophotography and organic electroluminescence | SANKIO CHEMICAL CO., LTD. (JP) | 2003-08-05 | — | — | US | disclosed |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |