Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611124 | 0.82 | NPC1 (0.47) | KMT2AMEN1ALDH1A1LMNACYP2C19 | |
| SCHEMBL11618645 | 0.78 | NPC1 (0.40) | NPSR1KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL11613046 | 0.76 | NPC1 (0.43) | KMT2AMEN1TSHRALDH1A1LMNA | |
| SCHEMBL11613095 | 0.74 | NPC1 (0.41) | KMT2AMEN1ALDH1A1LMNACYP2C19 | |
| SCHEMBL11613839 | 0.70 | PLA2G4A (0.35) | KMT2AMEN1KCNA5RXFP1ALDH1A1 | |
| SCHEMBL11614313 | 0.70 | NPC1 (0.44) | KMT2AMEN1ALDH1A1LMNACYP2C19 | |
| SCHEMBL11611800 | 0.70 | PTGDR2 (0.45) | KMT2AMEN1ALDH1A1LMNACYP2C19 | |
| SCHEMBL11612175 | 0.69 | KMT2A (0.45) | NPSR1KMT2AMEN1KCNA5ALDH1A1 | |
| SCHEMBL11612919 | 0.69 | HDAC6 (0.39) | KMT2ATSHRALDH1A1MAPTLMNA | |
| SCHEMBL4810433 | 0.69 | KMT2A (0.68) | KMT2AMEN1TSHRALDH1A1MAPT |
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-4117145-A | DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4113957-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-12 | — | — | US | disclosed |