Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 10/20 | 0.56 |
| ▸ | PPIA | P62937 | 2/20 | 0.56 |
| ▸ | PPID | Q08752 | 2/20 | 0.56 |
| ▸ | PPIL1 | Q9Y3C6 | 1/20 | 0.56 |
| ▸ | PPIB | P23284 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | NPY1R | P25929 | 1/20 | 0.30 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16550478 | 0.72 | PIN1 (1.00) | PIN1PPIAPPIDPPIL1PPIB | |
| SCHEMBL28641417 | 0.67 | CRHBP (0.53) | KDM4EALDH1A1MEN1KMT2AERN1 | |
| SCHEMBL3286500 | 0.60 | GPR35 (0.61) | KDM4EALDH1A1MEN1KMT2ACRHBP | |
| SCHEMBL9317554 | 0.60 | PIN1 (0.44) | PIN1KDM4EALDH1A1DRD2 | |
| SCHEMBL3207603 | 0.59 | GPR35 (0.44) | PIN1PPIAPPIDPPIL1KDM4E | |
| SCHEMBL7584497 | 0.58 | PDPK1 (0.42) | PIN1 | |
| SCHEMBL28635053 | 0.58 | CRHBP (0.49) | ALDH1A1POLBMEN1KMT2AERN1 | |
| SCHEMBL28646250 | 0.58 | CRHBP (0.49) | ALDH1A1ERN1CRHBPCRHR2 | |
| SCHEMBL28632790 | 0.58 | CRHBP (0.49) | ALDH1A1ERN1CRHBPCRHR2 | |
| SCHEMBL13082627 | 0.57 | XDH (0.50) | KDM4EALDH1A1POLBMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2845588-A1 | PIN1 inhibitors for use in the prevention and/or treatment of theileriosis, and related applications | Centre National de la Recherche Scientifique (C.N.R.S.) (FR) | 2015-03-11 | — | — | EP | disclosed |