Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLD1 | Q13393 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL8713624 | 0.76 | SIGMAR1 (0.41) | HTR7ALDH1A1HTR1ATSHRHSD17B10 | |
| SCHEMBL31511748 | 0.74 | PLD1 (0.43) | PLD1HTR7ALDH1A1KDM4EHTR1A | |
| SCHEMBL17329309 | 0.71 | ALDH1A1 (0.43) | PLD1ALDH1A1KDM4ETSHRHPGD | |
| SCHEMBL4177502 | 0.71 | PLD1 (0.43) | PLD1HTR7ALDH1A1SMN1; SMN2 | |
| SCHEMBL8716758 | 0.68 | ADRB1 (0.32) | ALDH1A1CYP3A4CYP2D6HPGD | |
| SCHEMBL8719888 | 0.68 | MAPT (0.31) | — | |
| SCHEMBL5113337 | 0.67 | CYP2D6 (0.42) | ALDH1A1KDM4ETSHRHSD17B10MEN1 | |
| SCHEMBL8718452 | 0.67 | ADRB1 (0.44) | HTR7ALDH1A1KDM4EHTR1ATSHR | |
| SCHEMBL5773950 | 0.67 | CYP2D6 (0.35) | ALDH1A1KDM4EMEN1CYP3A4CYP2D6 | |
| SCHEMBL4557820 | 0.66 | SIGMAR1 (0.41) | PLD1HTR7ALDH1A1KDM4EHSD17B10 |
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-0822939-A1 | CYCLIC PENTAPEPTIDE LH-RH RECEPTOR ANTAGONISTS | Takeda Chemical Industries, Ltd. (JP) | 1998-02-11 | — | — | EP | disclosed |
| WO-1996034012-A1 | CYCLIC PENTAPEPTIDE LH-RH RECEPTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-10-31 | — | — | WO | disclosed |