Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL16100242 | 1.00 | ELANE (0.38) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL30133793 | 0.85 | GAA (0.42) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL31622731 | 0.85 | ELANE (0.38) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL20517501 | 0.85 | MAPT (0.38) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL30133858 | 0.81 | TSHR (0.40) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL30134356 | 0.81 | MAPT (0.39) | ELANEALDH1A1HPGDTSHRGAA | |
| SCHEMBL30899996 | 0.81 | RAB9A (0.37) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL30133959 | 0.81 | ELANE (0.38) | ELANEALDH1A1HPGDTSHRTP53 | |
| SCHEMBL16244346 | 0.80 | TP53 (0.39) | ELANEALDH1A1TSHRTP53NPC1 | |
| SCHEMBL29222203 | 0.79 | ELANE (0.39) | ELANEALDH1A1HPGDTP53NPC1 |
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-2970134-A1 | PYRAZOLE DERIVATIVES ASPRMT1 INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014153090-A1 | PYRAZOLE DERIVATIVES ASPRMT1 INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2014-09-25 | — | — | WO | disclosed |