Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5365792 | 0.74 | KDM4E (0.49) | HPGDALDH1A1HSD17B10TSHRKDM4E | |
| SCHEMBL5366159 | 0.73 | HPGD (0.49) | NPC1HPGDALDH1A1HSD17B10TSHR | |
| Urea SCHEMBL27797099 | 0.72 | NPC1 (0.61) | NPC1HPGDALDH1A1HSD17B10TSHR | |
| Carbamic Acid SCHEMBL27930251 | 0.72 | NPC1 (0.61) | NPC1HPGDALDH1A1HSD17B10TSHR | |
| SCHEMBL5365804 | 0.72 | KDM4E (0.47) | HPGDALDH1A1HSD17B10TSHRKDM4E | |
| SCHEMBL5374606 | 0.71 | KMT2A (0.49) | HPGDHSD17B10TSHRHTTSMN1; SMN2 | |
| SCHEMBL4553234 | 0.71 | PTGS2 (0.48) | GAAPOLBMAPK1 | |
| SCHEMBL9980597 | 0.69 | ALDH1A1 (0.53) | NPC1HPGDALDH1A1HSD17B10TSHR | |
| SCHEMBL10002521 | 0.67 | HSD11B1 (0.58) | NPC1HPGDALDH1A1HSD17B10TSHR | |
| Oxalic Acid SCHEMBL28160737 | 0.67 | MAPT (0.63) | NPC1HPGDALDH1A1HSD17B10TSHR |
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-2627650-A2 | N-PHENYL IMIDAZOLE CARBOXAMIDE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE-1 | Merck Sharp & Dohme Corp. (US) | 2013-08-21 | — | — | EP | disclosed |
| WO-2011149874-A2 | N-PHENYL IMIDAZOLE CARBOXAMIDE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE-1 | SCHERING CORPORATION (US) | 2011-12-01 | — | — | WO | disclosed |