Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.57 |
| ▸ | HPGD | P15428 | 6/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | GLA | P06280 | 4/20 | 0.57 |
| ▸ | PDE5A | O76074 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 13/20 | 0.50 |
| ▸ | NPC1 | O15118 | 10/20 | 0.50 |
| ▸ | GAA | P10253 | 7/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL25599852 | 0.85 | ALDH1A1 (0.64) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL26578924 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL26578918 | 0.80 | RAB9A (0.65) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL10754329 | 0.80 | KDM4E (0.59) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL25112964 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL26578935 | 0.75 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL10759512 | 0.75 | PDE5A (0.52) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL218827 | 0.75 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL1691414 | 0.74 | ALDH1A1 (0.65) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL18999519 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDHSD17B10GLA |
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-4716169-A | INOTROPIC AGENTS | DR. KARL THOMAE GMBH (DE) | 1987-12-29 | — | — | US | disclosed |
| EP-0185345-A1 | Imidazo derivatives, their preparation and medicines containing them | Dr. Karl Thomae GmbH (DE) | 1986-06-25 | — | — | EP | disclosed |