Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.52 |
| ▸ | HTR1A | P08908 | 3/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.52 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.46 |
| ▸ | VDR | P11473 | 1/20 | 0.46 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL8980731 | 0.85 | KDM4E (0.47) | ABCB1KDM4ESMN1; SMN2NPC1GAA | |
| SCHEMBL8980720 | 0.84 | ENPP2 (0.54) | HTR1AKDM4ESMN1; SMN2NPC1RAB9A | |
| SCHEMBL8980573 | 0.84 | LRRK2 (0.54) | ABCB1HTR1ADRD2LRRK2KDM4E | |
| SCHEMBL1388008 | 0.82 | MRGPRX4 (0.59) | ABCB1HTR1ADRD2LRRK2KDM4E | |
| Water SCHEMBL8980780 | 0.82 | CAPN1 (0.49) | KDM4ERAB9AHTTKEAP1NFE2L2 | |
| SCHEMBL8980620 | 0.79 | PLA2G1B (0.46) | ABCB1HTR1AKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL8980628 | 0.77 | ABCB1 (0.50) | ABCB1HTR1ANPC1RAB9AADRA1D | |
| SCHEMBL3179257 | 0.77 | ABCB1 (0.52) | ABCB1HTR1ADRD2LRRK2KDM4E | |
| SCHEMBL1097700 | 0.77 | ABCB1 (0.52) | ABCB1HTR1ADRD2LRRK2KDM4E | |
| SCHEMBL1097263 | 0.75 | MRGPRX4 (0.56) | ABCB1HTR1ADRD2LRRK2SMN1; SMN2 |
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-0711288-A1 | PIPERAZINE DERIVATIVES AS ALPHA 1A-ADRENERGIC RECEPTOR ANTAGONISTS | RECORDATI INDUSTRIA CHIMICA E FARMACEUTICA S.p.a. (IT) | 1996-05-15 | — | — | EP | disclosed |
| WO-1995004049-A1 | PIPERAZINE DERIVATIVES AS α1A-ADRENERGIC RECEPTOR ANTAGONISTS | RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 1995-02-09 | — | — | WO | disclosed |