Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | BAP1 | Q92560 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11002475 | 0.91 | KDM4E (0.63) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL9637750 | 0.91 | KDM4E (0.74) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| Hydrochloric Acid SCHEMBL10334321 | 0.90 | KDM4E (0.73) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL11008926 | 0.89 | KDM4E (0.58) | ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL9837258 | 0.87 | ALDH1A1 (0.50) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL11002958 | 0.85 | KDM4E (0.56) | ALDH1A1KDM4ELMNA | |
| SCHEMBL11003970 | 0.85 | KDM4E (0.56) | ALDH1A1KDM4ELMNA | |
| SCHEMBL9637819 | 0.84 | KDM4E (0.58) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL11006943 | 0.84 | KDM4E (0.57) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL9866867 | 0.83 | ALDH1A1 (0.63) | ALDH1A1KDM4EHSD17B10LMNAHPGD |
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-5162338-A | For improving myocardial contractility; hypertensive agents, reducing mucosal swelling; salt and fluid balance | BAYER AKTIENGESELLSCHAFT (DE) | 1992-11-10 | — | — | US | disclosed |
| US-4904665-A | Benzylaminoaryl-dihydropyridinelactones and their use in medicaments | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | disclosed |
| US-4804667-A | CARDIOTONIC, INOTROPIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1989-02-14 | — | — | US | disclosed |