Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | HTT | P42858 | 5/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8980579 | 0.90 | TSHR (0.53) | ALDH1A1HTTNPSR1HPGDSMN1; SMN2 | |
| SCHEMBL8980703 | 0.88 | ALDH1A1 (0.62) | ALDH1A1HTTNPSR1HPGDSMN1; SMN2 | |
| SCHEMBL8980608 | 0.81 | L3MBTL1 (0.55) | HTTSMN1; SMN2MAPTGAARAB9A | |
| SCHEMBL28877532 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HTTHPGDL3MBTL1TSHR | |
| SCHEMBL8980558 | 0.77 | PTGER1 (0.50) | ALDH1A1HTTHPGDSMN1; SMN2MAPT | |
| SCHEMBL27968967 | 0.75 | TSHR (0.53) | ALDH1A1HTTHPGDL3MBTL1TSHR | |
| SCHEMBL15716659 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HTTNPSR1HPGDRAB9A | |
| SCHEMBL28957917 | 0.73 | TSHR (0.50) | ALDH1A1RAB9AL3MBTL1TSHRCYP3A4 | |
| SCHEMBL8876258 | 0.73 | TSHR (0.47) | ALDH1A1HPGDSMN1; SMN2MAPTRAB9A | |
| SCHEMBL1561432 | 0.72 | PPIA (0.53) | HTTNPSR1SMN1; SMN2MAPTCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1132508-A | Piperazine derivatives | REORDATI IND CHIMICA E FARMACE (CH) | 1996-10-02 | — | — | CN | disclosed |
| 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 |