Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23653737 | 0.84 | KMT2A (0.44) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| SCHEMBL15009038 | 0.81 | KEAP1 (0.60) | KMT2AKEAP1ALDH1A1TDP1MEN1 | |
| SCHEMBL28511692 | 0.80 | KMT2A (0.49) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| SCHEMBL23615906 | 0.77 | KMT2A (0.46) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| SCHEMBL20505646 | 0.76 | KMT2A (0.49) | KMT2AALDH1A1LMNAPOLBMAPK1 | |
| SCHEMBL20505057 | 0.75 | KMT2A (0.53) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| Hydrochloric Acid SCHEMBL23498163 | 0.73 | KEAP1 (0.46) | KMT2AKEAP1ALDH1A1POLBTDP1 | |
| SCHEMBL23498171 | 0.73 | KMT2A (0.42) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| SCHEMBL20561774 | 0.73 | KMT2A (0.58) | KMT2AKEAP1ALDH1A1LMNAPOLB | |
| SCHEMBL21939509 | 0.73 | KMT2A (0.50) | KMT2AALDH1A1LMNAMAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0274434-A1 | Dopamine-beta-hydroxylase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1988-07-13 | — | — | EP | disclosed |
| US-4749717-A | 1-(2- OR 3-THIENYLALKYL)IMIDAZOLE-2-THIOLS AND 1-(2- OR 3-THIENYLALKYL)-2-ALKLYTHIOMIDAZOLES; HYPOTENSIVE AGENT, DIURETIC | SMITHKLINE BECKMAN CORPORATION (US) | 1988-06-07 | — | — | US | disclosed |