Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL10637556 | 0.78 | KDM4E (0.36) | HSD17B10CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL10637608 | 0.71 | ADRA2A (0.70) | HSD17B10CYP1A2CYP3A4ALDH1A1KMT2A | |
| SCHEMBL9631092 | 0.71 | CA9 (0.59) | XDHTSHRKMT2AKDM4EMEN1 | |
| SCHEMBL11008112 | 0.71 | CA12 (0.59) | XDHALDH1A1TSHRKMT2APKM | |
| SCHEMBL10642524 | 0.70 | HTR7 (0.62) | HSD17B10CYP1A2CYP3A4ALDH1A1KMT2A | |
| SCHEMBL10642521 | 0.70 | ALDH1A1 (0.45) | HSD17B10CYP1A2MAPK1ALDH1A1KMT2A | |
| SCHEMBL17485266 | 0.70 | KMT2A (0.56) | HSD17B10CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL11014592 | 0.70 | ALDH1A1 (0.47) | CYP1A2ALDH1A1KMT2AKDM4EMEN1 | |
| SCHEMBL17242768 | 0.69 | ESR1 (0.52) | HSD17B10CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL4199990 | 0.68 | ALDH1A1 (0.69) | HSD17B10CYP1A2MAPK1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0161498-B1 | PHENYLPIPERAZINE DERIVATIVES AND THEIR ACID ADDITION SALTS | MITSUBISHI KASEI CORPORATION (JP) | 1988-10-12 | — | — | EP | disclosed |
| US-4716161-A | HYPOTENSIVE AGENTS | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) | 1987-12-29 | — | — | US | disclosed |
| EP-0161498-A1 | Phenylpiperazine derivatives and their acid addition salts | MITSUBISHI KASEI CORPORATION (JP) | 1985-11-21 | — | — | EP | disclosed |