Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | G6PD | P11413 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | CASP6 | P55212 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6442207 | 0.80 | ALB (0.52) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL367775 | 0.79 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL12757483 | 0.77 | CA1 (0.52) | KDM4ECA1CA2CA12CA7 | |
| SCHEMBL28169509 | 0.77 | HNF4A (0.54) | ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL28010040 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL29281777 | 0.77 | TSHR (0.45) | ALDH1A1HPGDCA1CA2CA12 | |
| SCHEMBL470708 | 0.77 | CA1 (0.54) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL8676658 | 0.74 | KDM4E (0.69) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL1270521 | 0.74 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4ECA1CA2 | |
| SCHEMBL17205188 | 0.73 | ALDH1A1 (0.48) | ALDH1A1HPGDKDM4ECA1CA2 |
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-109776377-A | Indoline-like compound and its preparation method and application | 沈阳药科大学 | 2019-05-21 | — | — | CN | disclosed |