Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | CCR1 | P32246 | 2/20 | 0.33 |
| ▸ | CCR8 | P51685 | 2/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12410188 | 0.86 | MEN1 (0.46) | ALDH1A1MEN1TSHRKMT2AMAPT | |
| SCHEMBL24971015 | 0.86 | PPARA (0.36) | ALDH1A1KMT2APPARAMAPTCCR1 | |
| SCHEMBL31143096 | 0.86 | PPARA (0.36) | ALDH1A1KMT2APPARAMAPTCCR1 | |
| SCHEMBL3877857 | 0.84 | MEN1 (0.35) | MEN1TSHRKMT2APPARAMAPT | |
| SCHEMBL9732163 | 0.73 | DRD4 (0.53) | MEN1KMT2AMAPTKDM4EMAPK1 | |
| SCHEMBL18289967 | 0.73 | L3MBTL1 (0.53) | ALDH1A1TSHRKMT2AMAPTCCR1 | |
| SCHEMBL31490208 | 0.72 | CCR1 (0.61) | KMT2AMAPTCCR1CCR5KDM4E | |
| SCHEMBL9186312 | 0.72 | CCR1 (0.61) | KMT2AMAPTCCR1CCR5KDM4E | |
| SCHEMBL7025162 | 0.71 | CCR1 (0.45) | MEN1TSHRKMT2APPARAMAPT | |
| SCHEMBL6888604 | 0.71 | CCR1 (0.67) | PPARAMAPTCCR1CCR8CCR5 |
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-5104884-A | Rheumatic diseases, fungicides | ALKALOIDA VEGYESZETI GYAR (HU) | 1992-04-14 | — | — | US | disclosed |
| EP-0221947-B1 | TRIAZOLYL QUINOLINE DERIVATIVES | ALKALOIDA VEGYéSZETI GYáR (HU) | 1990-11-28 | — | — | EP | disclosed |
| EP-0221947-A1 | TRIAZOLYL QUINOLINE DERIVATIVES. | ALKALOIDA VEGYESZETI GYAR (HU) | 1987-05-20 | — | — | EP | disclosed |
| WO-1986006721-A1 | TRIAZOLYL QUINOLINE DERIVATIVES | ALKALOIDA VEGYÉSZETI GYÁR (HU) | 1986-11-20 | — | — | WO | disclosed |