Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GALR3 | O60755 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18688898 | 0.76 | SMN1; SMN2 (0.44) | ALDH1A1TDP1TSHRSMN1; SMN2L3MBTL1 | |
| SCHEMBL180678 | 0.72 | ERN1 (0.39) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL6903174 | 0.72 | PTGS1 (0.32) | TDP1MEN1KMT2A | |
| SCHEMBL28021446 | 0.71 | HPRT1 (0.44) | ALDH1A1TDP1TSHRSMN1; SMN2L3MBTL1 | |
| SCHEMBL398817 | 0.70 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRSMN1; SMN2L3MBTL1 | |
| SCHEMBL28075565 | 0.70 | HTT (0.54) | ALDH1A1TDP1TSHRSMN1; SMN2L3MBTL1 | |
| SCHEMBL22712664 | 0.69 | TDP1 (0.40) | ALDH1A1TDP1TSHRSMN1; SMN2L3MBTL1 | |
| SCHEMBL8132797 | 0.69 | CA1 (0.43) | ALDH1A1TDP1TSHRL3MBTL1ERN1 | |
| SCHEMBL28188096 | 0.69 | ERN1 (0.42) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL28155707 | 0.69 | TDP1 (0.41) | ALDH1A1TDP1TSHRMEN1KMT2A |
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-107501099-A | The adjusting control agent of ATP combination cassette transporters | 沃泰克斯药物股份有限公司 | 2017-12-22 | — | — | CN | disclosed |