Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2928554 | 0.78 | ADORA2A (0.39) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL2928414 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL2922408 | 0.69 | ADORA2A (0.41) | ADORA2AADORA1 | |
| SCHEMBL2927024 | 0.65 | GBA1 (0.36) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL2922513 | 0.63 | CCNB2 (0.47) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL2928089 | 0.63 | ALDH1A1 (0.51) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL2926006 | 0.61 | PTGS2 (0.41) | ALDH1A1HPGDMAPTSMN1; SMN2NPC1 | |
| SCHEMBL23903921 | 0.59 | PIK3CD (0.42) | ALDH1A1HSD17B10HPGDMAPTKDM4E | |
| SCHEMBL2377244 | 0.57 | ALDH1A1 (0.54) | ALDH1A1MAPTKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL21135082 | 0.57 | APP (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1086950-B1 | HETEROCYCLIC INDOLE DERIVATIVES AND MONO- OR DIAZAINDOLE DERIVATIVES | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2010-09-29 | — | — | EP | claimed |