Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11547946 | 0.81 | NPSR1 (0.45) | HSD17B10ALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL11546967 | 0.79 | CA1 (0.42) | HSD17B10ALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL11551313 | 0.78 | TSHR (0.45) | HSD17B10ALDH1A1KDM4ELMNAL3MBTL1 | |
| SCHEMBL11549832 | 0.77 | HSD17B10 (0.39) | HSD17B10ALDH1A1KDM4ELMNAL3MBTL1 | |
| SCHEMBL11547587 | 0.77 | PKM (0.47) | HSD17B10ALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL11545904 | 0.77 | DHFR (0.48) | HSD17B10ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL11549829 | 0.77 | KMT2A (0.40) | HSD17B10ALDH1A1KDM4ELMNAL3MBTL1 | |
| SCHEMBL11550588 | 0.77 | CACNA1C (0.46) | ALDH1A1KDM4EL3MBTL1KMT2AMAPK1 | |
| SCHEMBL11555682 | 0.76 | ALDH1A1 (0.44) | HSD17B10ALDH1A1KDM4ELMNAL3MBTL1 | |
| SCHEMBL11547775 | 0.76 | CACNA1C (0.46) | ALDH1A1KDM4EL3MBTL1KMT2AMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4136187-A | CORONARY VESSEL DILATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1979-01-23 | — | — | US | claimed |
| US-3959292-A | HYPOTENSIVE AGENTS, CORONARY DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-25 | — | — | US | claimed |
| US-4136187-A | CORONARY VESSEL DILATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1979-01-23 | — | — | US | disclosed |
| US-3959292-A | HYPOTENSIVE AGENTS, CORONARY DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-25 | — | — | US | disclosed |