Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | ELANE | P08246 | 4/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 3/20 | 0.31 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.31 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.31 |
| ▸ | RASGRP3 | Q8IV61 | 2/20 | 0.31 |
| ▸ | RASGRP1 | O95267 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6229846 | 0.84 | ALDH1A1 (0.39) | NPC1ELANEALDH1A1KDM4EPOLB | |
| SCHEMBL2948314 | 0.75 | KDM4E (0.38) | NPC1ALDH1A1KDM4EMAPK1MAPT | |
| SCHEMBL3330677 | 0.74 | KMT2A (0.51) | NPC1ALDH1A1POLBKMT2ACYP1A2 | |
| SCHEMBL6015870 | 0.72 | ALDH1A1 (0.54) | ALDH1A1KDM4EPOLBNPSR1KMT2A | |
| SCHEMBL6230861 | 0.72 | — | — | |
| SCHEMBL6015950 | 0.70 | KMT2A (0.50) | ALDH1A1GAAKDM4EKMT2AMAPT | |
| SCHEMBL6015705 | 0.70 | MEN1 (0.41) | ALDH1A1NPSR1KMT2AMEN1 | |
| SCHEMBL5070865 | 0.69 | ALDH1A1 (0.54) | ALDH1A1GAAKDM4EPOLBKMT2A | |
| SCHEMBL9581979 | 0.69 | — | — | |
| SCHEMBL5497340 | 0.69 | ALDH1A1 (0.34) | ALDH1A1KDM4ENPSR1KMT2ACYP1A2 |
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-1595866-B1 | Cyanopyrrolidines useful for the treatment of inter alia metabolic syndrome | SANWA KAGAKU KENKYUSHO CO (JP) | 2016-06-08 | — | — | EP | disclosed |
| EP-1595866-A1 | COMPOUND INHIBITING DIPEPTIDYL PEPTIDASE IV | Sanwa Kagaku Kenkyusho Co., Ltd. (JP) | 2005-11-16 | — | — | EP | disclosed |