Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14155927 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL4833816 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL29113585 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL2953402 | 0.79 | ALDH1A1 (0.56) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL27966604 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL15630879 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL17557647 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL21820415 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL17557749 | 0.75 | ALDH1A1 (0.60) | ALDH1A1TSHRHSD17B10HPGDKDM4E | |
| SCHEMBL25141591 | 0.74 | ALDH1A1 (0.54) | ALDH1A1TSHRHSD17B10HPGDALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115448908-A | Compounds for the treatment of specific leukemias | 拓臻股份有限公司 | 2022-12-09 | — | — | CN | disclosed |
| CN-115215838-A | Compounds for the treatment of specific leukemias | 拓臻股份有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-112770745-B | Compounds for the treatment of specific leukemias | 拓臻股份有限公司 | 2022-09-02 | — | — | CN | disclosed |
| CN-112770745-A | Compounds for the treatment of specific leukemias | 拓臻股份有限公司 | 2021-05-07 | — | — | CN | disclosed |