Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4988305 | 0.84 | HTR1B (0.61) | HTR1BMEN1KMT2AHRH4KDM4E | |
| Hydrochloric Acid SCHEMBL4982786 | 0.83 | HTR1B (0.60) | HTR1BMEN1KMT2AHRH4KDM4E | |
| SCHEMBL14437848 | 0.81 | WDR5 (0.45) | HTR1BMEN1KMT2AHRH4KDM4E | |
| SCHEMBL5344999 | 0.78 | HTR2C (0.39) | MEN1KMT2AHRH4KDM4EALDH1A1 | |
| SCHEMBL4990430 | 0.78 | HTR1B (0.57) | HTR1BMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL5340176 | 0.76 | KDM4E (0.39) | HTR1BHRH4KDM4EALDH1A1GAA | |
| SCHEMBL14437495 | 0.75 | HTR1B (0.91) | HTR1BMAPTHPGD | |
| SCHEMBL14437527 | 0.75 | HTR1B (0.74) | HTR1BMEN1KMT2AALDH1A1POLB | |
| SCHEMBL11640545 | 0.73 | GPR35 (0.64) | MEN1KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL14263971 | 0.73 | HTR1B (0.78) | HTR1BKMT2AKDM4EALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007097697-A1 | THERAPEUTIC QUINOLINE COMPOUNDS THAT ARE 5HT1B MODULATORS | ASTRAZENECA AB (SE) | 2007-08-30 | — | — | WO | disclosed |
| WO-2007097697-A1 | THERAPEUTIC QUINOLINE COMPOUNDS THAT ARE 5HT1B MODULATORS | ASTRAZENECA AB (SE) | 2007-08-30 | — | — | WO | disclosed |