Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 9/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | HTR2B | P41595 | 2/20 | 0.52 |
| ▸ | HTR1D | P28221 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.49 |
| ▸ | DRD4 | P21917 | 4/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | HTR1B | P28222 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6546626 | 0.85 | ALDH1A1 (0.65) | KDM4EALDH1A1TDP1HTR1ADRD2 | |
| SCHEMBL6064337 | 0.85 | HTR1A (0.62) | HTR1AMEN1KMT2ADRD2HTR2B | |
| SCHEMBL10753828 | 0.78 | IGF1R (0.63) | KDM4EALDH1A1TDP1HTR1AMEN1 | |
| SCHEMBL6547111 | 0.76 | MAPT (0.53) | KDM4EALDH1A1TDP1HTR1AMEN1 | |
| SCHEMBL8781395 | 0.75 | HTR1A (0.73) | KDM4EALDH1A1HTR1AMEN1KMT2A | |
| SCHEMBL8442654 | 0.74 | HTR1A (0.80) | KDM4EALDH1A1TDP1HTR1ADRD2 | |
| SCHEMBL9004457 | 0.74 | HTR1A (0.80) | KDM4EALDH1A1TDP1HTR1ADRD2 | |
| SCHEMBL10756919 | 0.74 | DRD2 (0.52) | KDM4EALDH1A1TDP1HTR1AMEN1 | |
| SCHEMBL8648451 | 0.74 | HTR1A (0.55) | HTR1AMEN1KMT2ADRD2HTR2B | |
| Cyclohexane SCHEMBL8646429 | 0.74 | HTR1A (0.54) | ALDH1A1HTR1AMEN1KMT2ADRD2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1123926-A1 | Piperazine derivatives for treatment of CNS disorders | JOHN WYETH & BROTHER LIMITED (GB) | 2001-08-16 | — | — | EP | claimed |
| US-5369103-A | Anxiolytic agents, cental nervous system disorders | JOHN WYETH & BROTHER, LIMITED (GB) | 1994-11-29 | — | — | US | claimed |
| EP-0506905-A1 | PIPERAZINE DERIVATIVES | JOHN WYETH & BROTHER LIMITED (GB) | 1992-10-07 | — | — | EP | claimed |
| WO-1992006960-A1 | PIPERAZINE DERIVATIVES | JOHN WYETH & BROTHER LIMITED (GB) | 1992-04-30 | — | — | WO | claimed |
| EP-1123926-A1 | Piperazine derivatives for treatment of CNS disorders | JOHN WYETH & BROTHER LIMITED (GB) | 2001-08-16 | — | — | EP | disclosed |
| US-5369103-A | Anxiolytic agents, cental nervous system disorders | JOHN WYETH & BROTHER, LIMITED (GB) | 1994-11-29 | — | — | US | disclosed |