Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 7/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 5/20 | 0.32 |
| ▸ | CA1 | P00915 | 4/20 | 0.32 |
| ▸ | CA12 | O43570 | 3/20 | 0.32 |
| ▸ | CA9 | Q16790 | 3/20 | 0.32 |
| ▸ | CA5A | P35218 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4145387 | 0.82 | ALDH1A1 (0.44) | KMT2AALDH1A1HSD17B10TDP1GAA | |
| SCHEMBL4362006 | 0.82 | ALDH1A1 (0.38) | ALDH1A1GAA | |
| SCHEMBL28859407 | 0.82 | CA2 (0.50) | VCAM1ALDH1A1TDP1CA2CA1 | |
| SCHEMBL12466911 | 0.81 | ALDH1A1 (0.43) | KMT2AALDH1A1HSD17B10TDP1GAA | |
| SCHEMBL9320310 | 0.78 | CA1 (0.53) | VCAM1ALDH1A1GAAHTTCA2 | |
| SCHEMBL6759088 | 0.78 | ALDH1A1 (0.53) | VCAM1KMT2AALDH1A1GAAHTT | |
| SCHEMBL9322097 | 0.74 | MMP2 (0.44) | ALDH1A1MMP2 | |
| SCHEMBL9320555 | 0.74 | KMT2A (0.32) | KMT2AALDH1A1TDP1GAAHTT | |
| SCHEMBL2041738 | 0.74 | VCAM1 (0.56) | VCAM1KMT2AALDH1A1HTTMEN1 | |
| SCHEMBL2041314 | 0.73 | ALDH1A1 (0.58) | VCAM1KMT2AALDH1A1GAAHTT |
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-112979631-A | PARG inhibiting compounds | 癌症研究科技有限公司 | 2021-06-18 | — | — | CN | disclosed |
| CN-107295799-B | PARG inhibiting compounds | 癌症研究科技有限公司 | 2021-03-16 | — | — | CN | disclosed |