Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31168072 | 0.78 | CHEK1 (0.43) | CHEK1MAPK8SLC6A2SLC6A4PIM1 | |
| SCHEMBL17260094 | 0.78 | NPC1 (0.38) | SLC6A2PIM1GAAKDM4EKMT2A | |
| SCHEMBL6518415 | 0.77 | CHEK1 (0.49) | CHEK1MAPK8SLC6A2SLC6A4PIM1 | |
| SCHEMBL9901975 | 0.76 | AKR1C2 (0.47) | CHEK1MAPK8PIM1KDM4EKMT2A | |
| SCHEMBL8165166 | 0.76 | PLA2G4A (0.46) | MAPK8PIM1EPHX1KMT2AMRGPRX4 | |
| SCHEMBL15108843 | 0.75 | SLC6A2 (0.47) | CHEK1MAPK8SLC6A2SLC6A4PIM1 | |
| SCHEMBL17260100 | 0.75 | GAA (0.48) | GAAKDM4EKMT2AEPHX2ALDH1A1 | |
| SCHEMBL7105508 | 0.74 | ALDH1A1 (0.41) | SLC6A2SLC6A4KDM4EKMT2AALDH1A1 | |
| SCHEMBL22092981 | 0.74 | DGAT1 (0.51) | CHEK1MAPK8SLC6A2SLC6A4PIM1 | |
| SCHEMBL2314619 | 0.74 | CHEK1 (0.47) | CHEK1MAPK8SLC6A2SLC6A4PIM1 |
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-1178802-A4 | CYCLIC AMIDINES USEFUL AS NMDA NR2B ANTAGONISTS | MERCK & CO INC (US) | 2003-06-04 | — | — | EP | disclosed |
| EP-1178802-A1 | CYCLIC AMIDINES USEFUL AS NMDA NR2B ANTAGONISTS | Merck & Co., Inc. (US) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000067755-A1 | CYCLIC AMIDINES USEFUL AS NMDA NR2B ANTAGONISTS | MERCK & CO., INC. (US) | 2000-11-16 | — | — | WO | disclosed |