Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13639667 | 0.84 | CYP11B2 (0.36) | KDM4ECXCL12SLC6A4KMT2AMAPT | |
| SCHEMBL2151666 | 0.80 | KDM4E (0.55) | KDM4ECXCL12KMT2AMAPTLMNA | |
| SCHEMBL2151655 | 0.80 | KDM4E (0.55) | KDM4ECXCL12KMT2AMAPTLMNA | |
| SCHEMBL12446099 | 0.74 | ERN1 (0.37) | CXCL12SLC6A4KMT2ALMNAERN1 | |
| SCHEMBL13639590 | 0.71 | CYP11B2 (0.32) | SLC6A4ERN1CYP11B1CYP11B2 | |
| SCHEMBL1765256 | 0.71 | LMNA (0.50) | SLC6A4HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL12446116 | 0.71 | GRIN1 (0.43) | KDM4EKMT2AMAPTLMNAGAA | |
| SCHEMBL13639648 | 0.71 | TRPA1 (0.43) | KDM4ECXCL12SLC6A4KMT2AMAPT | |
| SCHEMBL13639629 | 0.70 | NFE2L2 (0.44) | KDM4EKMT2AMAPTGAAMEN1 | |
| SCHEMBL16953295 | 0.70 | KDM4E (0.51) | KDM4EHTR3EHTR3BHTR3AHTR3D |
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-2340021-B1 | SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES | HOFFMANN LA ROCHE (CH) | 2012-11-07 | — | — | EP | disclosed |