Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.46 |
| ▸ | HTR3B | O95264 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 2/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11542615 | 0.89 | NPSR1 (0.46) | NPSR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11540070 | 0.89 | NPSR1 (0.46) | NPSR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11541055 | 0.89 | NPSR1 (0.46) | NPSR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL6998519 | 0.88 | KDR (0.47) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL11538165 | 0.88 | NPSR1 (0.51) | NPSR1HTTMAPTKDM4EHPGD | |
| SCHEMBL11544638 | 0.88 | THRB (0.45) | NPSR1HTTMAPTALDH1A1PKM | |
| SCHEMBL11540447 | 0.87 | POLB (0.45) | NPSR1HTTMAPTALDH1A1KDM4E | |
| SCHEMBL11575819 | 0.87 | HTT (0.40) | NPSR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11539823 | 0.86 | BACE1 (0.49) | NPSR1HTTMAPTALDH1A1KDM4E | |
| SCHEMBL11542744 | 0.85 | KMT2A (0.45) | NPSR1HTTMAPTALDH1A1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4168312-A | Quinolone derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-09-18 | — | — | US | disclosed |