Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | VNN1 | O95497 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.39 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17608479 | 0.87 | VNN1 (0.43) | ARVNN1PTGER4ESR1MAOB | |
| SCHEMBL17608449 | 0.81 | PTGER4 (0.51) | PTGDR2PTGER4ELANEF2RL3 | |
| SCHEMBL17624291 | 0.81 | ELANE (0.53) | VNN1PTGDR2PTGER4ELANEF2RL3 | |
| SCHEMBL17624218 | 0.80 | HSD11B1 (0.46) | PTGDR2PTGER4ELANEHDAC8ACHE | |
| SCHEMBL1216862 | 0.78 | CYP1A2 (0.51) | PTGDR2PTGER4ELANEALDH1A1HPGD | |
| SCHEMBL1214836 | 0.75 | ELANE (0.64) | PTGDR2PTGER4ELANEALDH1A1MAPT | |
| SCHEMBL17608381 | 0.72 | ELANE (0.46) | PTGDR2PTGER4ELANEHDAC8SLC16A3 | |
| SCHEMBL30602811 | 0.69 | PTGDR2 (0.46) | PTGDR2PTGER4ACHENPC1ALDH1A1 | |
| SCHEMBL17608644 | 0.69 | PTGER4 (0.51) | PTGER4MAPTRAB9AF2RL3 | |
| SCHEMBL1129158 | 0.69 | RECQL (0.66) | HDAC8NPC1ALDH1A1MAPTHPGD |
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-2016041618-A1 | SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES | MERCK PATENT GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |
| WO-2016041618-A1 | SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES | MERCK PATENT GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |