Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | NPC1 | O15118 | 6/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TYK2 | P29597 | 2/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30622190 | 1.00 | RAB9A (0.44) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL15698698 | 0.84 | RAB9A (0.50) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL15698590 | 0.81 | BRD4 (0.43) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL29133000 | 0.80 | ALOX5AP (0.46) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL4230324 | 0.80 | NPC1 (0.65) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL30622184 | 0.80 | TDP1 (0.49) | RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL29133132 | 0.80 | TDP1 (0.49) | RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL18415083 | 0.79 | SMN1; SMN2 (0.43) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL17198745 | 0.79 | BRD4 (0.45) | RAB9ANPC1BRD4SMN1; SMN2NPSR1 | |
| SCHEMBL8177826 | 0.79 | RAB9A (0.47) | RAB9ANPC1BRD4SMN1; SMN2PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117088884-A | Imidazopyridazine derivatives as GABAA receptor modulators, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-21 | — | — | CN | disclosed |