Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8130450 | 0.93 | ALDH1A1 (0.46) | TSHRALDH1A1POLBHPGDKDM4E | |
| SCHEMBL7830591 | 0.72 | SLC10A2 (0.47) | ALDH1A1POLBKDM4EHTTRECQL | |
| SCHEMBL7822008 | 0.71 | RECQL (0.47) | TSHRALDH1A1POLBKDM4ERECQL | |
| SCHEMBL8131460 | 0.69 | PDE4A (0.42) | TSHRALDH1A1HPGDKDM4EHTT | |
| SCHEMBL7819852 | 0.68 | WHR1 (0.48) | ALDH1A1HPGDHIF1AKDM4EMAPT | |
| SCHEMBL8492206 | 0.68 | TLR9 (0.39) | ALDH1A1HPGDHIF1AKDM4EHTT | |
| SCHEMBL8138601 | 0.67 | WHR1 (0.42) | ALDH1A1POLBHPGDHIF1AKDM4E | |
| SCHEMBL8884921 | 0.67 | KDM4E (0.48) | ALDH1A1HPGDHIF1AKDM4EHTT | |
| SCHEMBL7825968 | 0.66 | WHR1 (0.46) | ALDH1A1HPGDHIF1AKDM4EMAPT | |
| SCHEMBL7820197 | 0.66 | PDE4A (0.48) | ALDH1A1POLBHPGDKDM4EHTT |
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-0634169-B1 | Quinoline or quinazoline derivatives and their use in the manufacture of a medicament for the treatment of osteoporosis | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2000-01-05 | — | — | EP | disclosed |
| EP-0634169-A1 | Pharmaceutical composition containing quinoline or quinazoline derivatives | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-01-18 | — | — | EP | disclosed |