Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 3/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16445891 | 0.86 | HMGCR (0.56) | HMGCRPTPN1ALDH1A1MAPTKDM4E | |
| SCHEMBL4764948 | 0.77 | TAAR1 (0.44) | HMGCRALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL3645037 | 0.77 | HMGCR (0.42) | HMGCRPTPN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6620053 | 0.77 | PTGER4 (0.48) | ALDH1A1MAPTKDM4EMEN1RECQL | |
| SCHEMBL875687 | 0.77 | HMGCR (0.44) | HMGCRALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL16333910 | 0.75 | HMGCR (0.65) | HMGCRHTR2AHTT | |
| SCHEMBL1766003 | 0.75 | PPARA (0.54) | FDPSALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL4774081 | 0.74 | HMGCR (0.42) | HMGCRHTR2AALDH1A1MAPTKDM4E | |
| SCHEMBL3402738 | 0.74 | EHMT2 (0.45) | — | |
| SCHEMBL1545475 | 0.74 | HTT (0.70) | HMGCRALDH1A1MAPTKMT2ACYP3A4 |
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-0730452-A4 | HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS | HOECHST ROUSSEL PHARMA (US) | 1997-03-19 | — | — | EP | disclosed |
| EP-0730452-A1 | HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS | HOECHST MARION ROUSSEL, Inc. (US) | 1996-09-11 | — | — | EP | disclosed |