Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | MMP2 | P08253 | 1/20 | 0.55 |
| ▸ | MMP8 | P22894 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8354141 | 0.87 | ALDH1A1 (0.58) | ALDH1A1TSHRLMNAKDM4ECYP1A2 | |
| SCHEMBL8350678 | 0.86 | MMP2 (0.65) | ALDH1A1TSHRLMNAMMP2MMP8 | |
| SCHEMBL8351289 | 0.82 | THRB (0.63) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| SCHEMBL8353686 | 0.82 | ALDH1A1 (0.56) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| SCHEMBL8353194 | 0.78 | ALDH1A1 (0.61) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| SCHEMBL8350094 | 0.74 | POLB (0.59) | ALDH1A1TSHRHSD17B10LMNAMMP2 | |
| SCHEMBL8356443 | 0.73 | ALDH1A1 (0.60) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| SCHEMBL8354101 | 0.73 | SLC27A1 (0.66) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL1374032 | 0.72 | ALDH1A1 (0.67) | ALDH1A1TSHRHSD17B10LMNAKDM4E | |
| SCHEMBL7008324 | 0.71 | ITGB3 (0.52) | MMP2MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999031096-A1 | PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS | SHAMAN PHARMACEUTICALS, INC. (US) | 1999-06-24 | — | — | WO | claimed |
| WO-1999031096-A1 | PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS | SHAMAN PHARMACEUTICALS, INC. (US) | 1999-06-24 | — | — | WO | disclosed |