Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.62 |
| ▸ | TOP1 | P11387 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | ARG2 | P78540 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | PAM | P19021 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL531474 | 0.85 | MAOB (0.65) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL531475 | 0.85 | MAOB (0.65) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL27988130 | 0.85 | MAOB (0.65) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL13784804 | 0.82 | MAOB (0.60) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL27489761 | 0.82 | MAOB (0.60) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL6971091 | 0.80 | GPR52 (0.56) | GPR52 | |
| SCHEMBL155055 | 0.79 | MAOB (1.00) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL155054 | 0.79 | MAOB (1.00) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL1524697 | 0.79 | MAOB (1.00) | MAOBTOP1CA1CA2ARG2 | |
| SCHEMBL6964850 | 0.77 | HDAC3 (0.48) | TOP1KEAP1LMNAGPR52CYP2C19 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |