Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.38 |
| ▸ | CA2 | P00918 | 8/20 | 0.38 |
| ▸ | CA12 | O43570 | 7/20 | 0.38 |
| ▸ | CA7 | P43166 | 7/20 | 0.38 |
| ▸ | CA9 | Q16790 | 7/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.38 |
| ▸ | CA4 | P22748 | 4/20 | 0.38 |
| ▸ | CA6 | P23280 | 4/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SELL | P14151 | 2/20 | 0.38 |
| ▸ | SELP | P16109 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6631013 | 0.79 | CYP1A2 (0.44) | CA1CA2CA12CA7CA9 | |
| SCHEMBL6632562 | 0.79 | CA1 (0.38) | CA1CA2CA12CA7CA9 | |
| SCHEMBL2779103 | 0.69 | TSHR (0.48) | CA1CA2CA12CA7CA9 | |
| SCHEMBL16442455 | 0.68 | TSHR (0.42) | CA1CA2CA12CA7CA9 | |
| SCHEMBL5418093 | 0.67 | KDM4E (0.41) | CA1CA2CA12CA7CA9 | |
| SCHEMBL2779477 | 0.65 | CYP1A2 (0.44) | CA1CA2CA12CA7CA9 | |
| SCHEMBL8647171 | 0.64 | ALDH1A1 (0.33) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL49732 | 0.62 | MGAM (0.42) | KDM4EMAPTPOLBALDH1A1HPGD | |
| SCHEMBL29419955 | 0.62 | CA1 (0.68) | CA1CA2CA12CA7CA9 | |
| SCHEMBL2971000 | 0.62 | CA1 (0.68) | CA1CA2CA12CA7CA9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105838758-A | Water soluble phenolics derivatives with dermocosmetic and therapeutic applications | 利布莱根公司 | 2016-08-10 | — | — | CN | disclosed |
| CN-1276035-C | Water-color ink | MITSUI CHEMICALS INC (JP) | 2006-09-20 | — | — | CN | disclosed |
| CN-1558934-A | Water-color ink | 三井化学株式会社 | 2004-12-29 | — | — | CN | disclosed |
| US-20040231558-A1 | Has a clear hue, high light fastness and high moisture resistance | MITSUI CHEMICALS, INC. (JP) | 2004-11-25 | — | — | US | disclosed |
| EP-1441013-A1 | WATERCOLOR INK | Mitsui Chemicals, Inc. (JP) | 2004-07-28 | — | — | EP | disclosed |