Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | FAAH | O00519 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | PHGDH | O43175 | 1/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL10825084 | 0.90 | ALDH1A1 (0.70) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| Bicarbonate SCHEMBL21981463 | 0.85 | SIGMAR1 (0.85) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL7573306 | 0.83 | SIGMAR1 (0.96) | SIGMAR1ALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL8145866 | 0.83 | SIGMAR1 (0.96) | SIGMAR1ALDH1A1LMNAKMT2AMEN1 | |
| Urea SCHEMBL6942597 | 0.82 | SIGMAR1 (0.79) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| Acetic Acid SCHEMBL7452259 | 0.82 | SIGMAR1 (0.79) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL9538814 | 0.81 | SIGMAR1 (0.92) | SIGMAR1ALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL13185789 | 0.81 | SIGMAR1 (0.72) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL83548 | 0.81 | SIGMAR1 (1.00) | SIGMAR1ALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL152631 | 0.81 | SIGMAR1 (1.00) | SIGMAR1ALDH1A1LMNAKMT2AMEN1 |
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-0927170-A1 | PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS | SCHERING CORPORATION (US) | 1999-07-07 | — | — | EP | disclosed |
| WO-1998008826-A1 | PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS | SCHERING CORPORATION (US) | 1998-03-05 | — | — | WO | disclosed |