Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | METAP2 | P50579 | 1/20 | 0.48 |
| ▸ | METAP1 | P53582 | 1/20 | 0.48 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.42 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | ALPL | P05186 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2765284 | 0.98 | KMT2A (0.52) | KMT2AMEN1LMNAMETAP2METAP1 | |
| SCHEMBL16766999 | 0.86 | LMNA (0.36) | KMT2AMEN1LMNAMETAP2METAP1 | |
| SCHEMBL16800868 | 0.80 | CYP1A2 (0.45) | KMT2AMEN1LMNAMETAP2RAB9A | |
| SCHEMBL9089922 | 0.79 | SYK (0.39) | KMT2AMEN1LMNAMETAP2METAP1 | |
| SCHEMBL5111323 | 0.78 | NOTUM (0.36) | KMT2AMEN1LMNAMETAP2METAP1 | |
| SCHEMBL1436161 | 0.77 | LMNA (0.58) | KMT2AMEN1LMNAENPP3RAB9A | |
| SCHEMBL6344688 | 0.76 | MAPT (0.46) | KMT2AMEN1RAB9AALPLPOLB | |
| SCHEMBL6599673 | 0.76 | LMNA (0.32) | KMT2AMEN1LMNA | |
| SCHEMBL3442252 | 0.76 | METAP2 (0.50) | KMT2AMEN1LMNAMETAP2RAB9A | |
| SCHEMBL989177 | 0.76 | CA12 (0.42) | KMT2AMEN1RAB9AALPLPOLB |
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-2758398-B1 | SUBSTITUTED N- [1-CYANO-2- (PHENYL) ETHYL]-2-AZABICYCLO [2.2.1]HEPTANE-3-CARBOXAMIDE INHIBITORS OF CATHEPSIN C | BOEHRINGER INGELHEIM INT (DE) | 2017-08-02 | — | — | EP | disclosed |