Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK2A1 | P68400 | 7/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.43 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.41 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1671897 | 0.83 | ALDH1A1 (0.57) | CSNK2A1CYP4F2CYP4A11KLKB1ALDH1A1 | |
| SCHEMBL22627397 | 0.83 | ALDH1A1 (0.47) | CSNK2A1CYP4F2CYP4A11KLKB1CSNK2A2 | |
| Hydrochloric Acid SCHEMBL1671401 | 0.81 | ALDH1A1 (0.55) | CSNK2A1CYP4F2CYP4A11KLKB1ALDH1A1 | |
| SCHEMBL31343271 | 0.81 | LOXL2 (0.54) | CYP4F2CYP4A11ALDH1A1LOXL2KDM4E | |
| SCHEMBL14817015 | 0.81 | LOXL2 (0.54) | CYP4F2CYP4A11ALDH1A1LOXL2KDM4E | |
| Hydrochloric Acid SCHEMBL30933600 | 0.80 | LOXL2 (0.53) | CSNK2A1CYP4F2CYP4A11ALDH1A1LOXL2 | |
| Hydrochloric Acid SCHEMBL9931554 | 0.80 | LOXL2 (0.53) | CSNK2A1CYP4F2CYP4A11ALDH1A1LOXL2 | |
| SCHEMBL11207193 | 0.79 | ALDH1A1 (0.52) | KLKB1ALDH1A1LOXL2MAOBKDM4E | |
| SCHEMBL21632307 | 0.79 | PLG (0.49) | KLKB1MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL18006675 | 0.79 | CYP4F2 (0.45) | CYP4F2CYP4A11ALDH1A1 |
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 |