Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2648031 | 0.98 | ALDH1A1 (0.47) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 | |
| SCHEMBL5501 | 0.90 | ALDH1A1 (0.53) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 | |
| SCHEMBL4958458 | 0.86 | ALDH1A1 (0.56) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 | |
| SCHEMBL8290941 | 0.86 | ALDH1A1 (0.56) | ALDH1A1DRD2SIGMAR1GAAMEN1 | |
| SCHEMBL15043685 | 0.84 | ALDH1A1 (0.59) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 | |
| SCHEMBL8290942 | 0.84 | ALDH1A1 (0.55) | ALDH1A1DRD2SIGMAR1GAAMEN1 | |
| SCHEMBL2649295 | 0.82 | KDM4E (0.46) | ALDH1A1SIGMAR1KDM4ELMNAKMT2A | |
| SCHEMBL1377151 | 0.76 | ALDH1A1 (0.40) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 | |
| SCHEMBL2916590 | 0.76 | HSD17B10 (0.45) | ALDH1A1KDM4ENPC1RAB9AGAA | |
| SCHEMBL23269699 | 0.76 | ALDH1A1 (0.51) | ALDH1A1DRD2SIGMAR1KDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0551993-B1 | Pyrrolidine derivatives and process for preparing the same | SUMITOMO PHARMA (JP) | 1996-07-10 | — | — | EP | disclosed |
| US-5322952-A | Pyrrolidine derivatives and process for preparing the same | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1994-06-21 | — | — | US | disclosed |
| EP-0551993-A1 | Pyrrolidine derivatives and process for preparing the same | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1993-07-21 | — | — | EP | disclosed |