Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.41 |
| ▸ | PAM | P19021 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | TOP1 | P11387 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ARG2 | P78540 | 1/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL3247823 | 0.78 | ALDH1A1 (0.52) | MAOBAKR1B1CES2CES1TOP1 | |
| SCHEMBL10936100 | 0.76 | MAOB (0.40) | MAOBPAMAKR1B1CES2CES1 | |
| SCHEMBL10534809 | 0.73 | MAOB (0.47) | MAOBHCAR2AKR1B1CES2CES1 | |
| SCHEMBL10534805 | 0.73 | MAOB (0.47) | MAOBHCAR2AKR1B1CES2CES1 | |
| SCHEMBL26288 | 0.72 | HCAR2 (0.67) | HCAR2AKR1B1LMNAALDH1A1TDP1 | |
| SCHEMBL16087781 | 0.72 | TSHR (0.53) | MAOBLMNATSHRALDH1A1CA1 | |
| SCHEMBL2158098 | 0.71 | MAOB (0.48) | MAOBAKR1B1CES2CES1TOP1 | |
| Water SCHEMBL5221672 | 0.71 | HCAR2 (0.65) | HCAR2AKR1B1LMNAALDH1A1TDP1 | |
| SCHEMBL28387923 | 0.71 | MAOB (0.54) | MAOBHCAR2AKR1B1CES2CES1 | |
| SCHEMBL11116639 | 0.69 | HCAR2 (0.69) | MAOBHCAR2AKR1B1LMNATSHR |
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-1713483-A1 | CHEMOKINE INHIBITING PIPERAZINE DERIVATIVES AND THEIR USE TO TREAT MULTIPLE MYELOMA | Schering Aktiengesellschaft (DE) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005077372-A1 | CHEMOKINE INHIBITING PIPERAZINE DERIVATIVES AND THEIR USE TO TREAT MULTIPLE MYELOMA | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-08-25 | — | — | WO | disclosed |