Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.43 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | TDO2 | P48775 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24113196 | 0.90 | ALOX15 (0.46) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL4044128 | 0.90 | ALOX15 (0.50) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL28465136 | 0.89 | ALDH1A1 (0.48) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL3276933 | 0.86 | ALOX15 (0.47) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL28459983 | 0.86 | ALDH1A1 (0.46) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL22620603 | 0.85 | XDH (0.50) | HPGDKDM4ELMNAGLAGAA | |
| SCHEMBL28844731 | 0.84 | ALOX15 (0.45) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL22042078 | 0.84 | CDK1 (0.58) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL5357191 | 0.84 | CDK1 (0.52) | ALOX15HPGDKDM4EALDH1A1RAB9A | |
| SCHEMBL28844598 | 0.84 | CDK1 (0.41) | ALOX15HPGDKDM4EALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110483366-B | Indole compound and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-09-16 | — | — | CN | disclosed |
| CN-107098846-B | N-acyl sulfonamide FBPase inhibitor, preparation method thereof, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-10-09 | — | — | CN | disclosed |