Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28713144 | 0.86 | ALDH1A1 (0.36) | ALDH1A1HSD17B10ALOX15TP53KDM4E | |
| SCHEMBL28710871 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KDM4EMAPTPOLBSMN1; SMN2 | |
| SCHEMBL6013771 | 0.79 | KDM4E (0.40) | ALDH1A1HSD17B10TP53KDM4EMAPT | |
| SCHEMBL12854037 | 0.74 | — | — | |
| SCHEMBL27345991 | 0.74 | HDAC3 (0.31) | CYP2D6CYP2C19 | |
| SCHEMBL8727943 | 0.73 | LMNA (0.33) | ALDH1A1HSD17B10MAPTSMN1; SMN2KMT2A | |
| SCHEMBL28622648 | 0.70 | PPARA (0.57) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL28622647 | 0.70 | PPARA (0.57) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL17461773 | 0.70 | — | — | |
| SCHEMBL11200813 | 0.69 | ALDH1A1 (0.71) | ALDH1A1HSD17B10ALOX15TP53KDM4E |
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-113943296-A | Pyrrolopyrimidine derivatives and uses thereof | 武汉人福创新药物研发中心有限公司 | 2022-01-18 | — | — | CN | disclosed |