Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 14/20 | 0.46 |
| ▸ | KDM6B | O15054 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | KDM4A | O75164 | 3/20 | 0.43 |
| ▸ | KDM4D | Q6B0I6 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10061709 | 0.80 | ALDH1A1 (0.45) | KDM4EALDH1A1MAPTTDP1MTNR1A | |
| Acetic Acid SCHEMBL16666943 | 0.80 | KDM4C (0.49) | KDM4CKDM6BKMT2AKDM4EKDM4A | |
| SCHEMBL30465694 | 0.79 | KDM4C (0.51) | KDM4CKDM6BKMT2AKDM4EKDM4A | |
| SCHEMBL123203 | 0.79 | KDM4C (0.51) | KDM4CKDM6BKMT2AKDM4EKDM4A | |
| SCHEMBL16196603 | 0.79 | KMT2A (0.48) | KMT2AL3MBTL1MTNR1ANPSR1CYP11B2 | |
| SCHEMBL2370442 | 0.78 | KDM4C (0.46) | KDM4CKDM6BKMT2AKDM4EKDM4A | |
| SCHEMBL14960629 | 0.77 | SOST (0.54) | KDM4CALDH1A1TDP1MTNR1ANPSR1 | |
| SCHEMBL9848860 | 0.76 | HTT (0.57) | KMT2AKDM4EALDH1A1L3MBTL1MTNR1A | |
| SCHEMBL3880004 | 0.75 | KDM4C (0.50) | KDM4CKDM6BKMT2AKDM4EKDM4A | |
| SCHEMBL258369 | 0.75 | KDM4C (0.51) | KDM4CKDM6BKMT2AKDM4EKDM4A |
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-2124913-A1 | 1-AMINOMETHYL- L- PHENYL- CYCLOHEXANE DERIVATIVES AS DDP-IV INHIBITORS | Novartis AG (CH) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008077597-A1 | 1-AMINOMETHYL- L- PHENYL- CYCLOHEXANE DERIVATIVES AS DDP-IV INHIBITORS | NOVARTIS AG (CH) | 2008-07-03 | — | — | WO | disclosed |