Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GRM8 | O00222 | 1/20 | 0.38 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL15902913 | 0.82 | ALDH1A1 (0.44) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28165765 | 0.82 | CCR1 (0.47) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28443642 | 0.79 | ALDH1A1 (0.44) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28444694 | 0.79 | NPC1 (0.44) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL15986584 | 0.79 | NPC1 (0.44) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28165762 | 0.78 | KDM4E (0.47) | GRM4NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL15904325 | 0.76 | GAA (0.51) | MAPT | |
| SCHEMBL10696996 | 0.75 | KMT2A (0.46) | NPC1ALDH1A1CYP2D6CYP2C19KDM4E | |
| SCHEMBL28438986 | 0.74 | L3MBTL1 (0.44) | GRM4NPC1ALDH1A1KDM4ERAB9A | |
| SCHEMBL9585297 | 0.73 | CCR1 (0.50) | GRM4NPC1ALDH1A1KDM4ERAB9A |
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-5214043-A | Controlling parasitic protozoa and fish parasites | BAYER AKTIENGESELLSCHAFT (DE) | 1993-05-25 | — | — | US | disclosed |
| US-5114938-A | Antiprotozoa agents and parasiticides | BAYER AKTIENGESELLSCHAFT (DE) | 1992-05-19 | — | — | US | disclosed |
| EP-0377903-A2 | Substituted hexahydro-1,2,4-triazine diones, processes for their preparation, intermediates and their use | BAYER AG (DE) | 1990-07-18 | — | — | EP | disclosed |