Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MDM4 | O15151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.35 |
| ▸ | PTGES | O14684 | 5/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16670731 | 1.00 | DPP4 (0.39) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16671832 | 0.95 | DPP4 (0.38) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16671833 | 0.95 | DPP4 (0.38) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16671628 | 0.92 | ALOX5 (0.40) | LMNAHPGDALOX12ATMSMN1; SMN2 | |
| SCHEMBL16682194 | 0.92 | ALOX5 (0.40) | LMNAHPGDALOX12ATMSMN1; SMN2 | |
| SCHEMBL16671060 | 0.88 | DDR1 (0.38) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16671059 | 0.88 | DDR1 (0.38) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16682136 | 0.86 | CYP1A1 (0.46) | DPP4LMNAHPGDALOX12ATM | |
| SCHEMBL16670998 | 0.78 | CA1 (0.39) | EPHX2NR1H4PTGESHDAC6 | |
| SCHEMBL16682176 | 0.76 | DDR1 (0.35) | EPHX2NR1H4PTGES |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015059618-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS mPGES-1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2015-04-30 | — | — | WO | disclosed |
| WO-2015059618-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS mPGES-1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2015-04-30 | — | — | WO | disclosed |