Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.44 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ATIC | P31939 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 2/20 | 0.33 |
| ▸ | CHAT | P28329 | 1/20 | 0.33 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.33 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.33 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.33 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | FABP4 | P15090 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL1413138 | 0.78 | AURKA (0.39) | AURKAAURKBTTRCYP1A2ALDH1A1 | |
| SCHEMBL7065517 | 0.78 | CYP1A2 (0.47) | AURKAAURKBTTRCYP1A2SNCA | |
| SCHEMBL1413154 | 0.78 | TTR (0.34) | AURKAAURKBCOMTTTRCYP1A2 | |
| SCHEMBL5031748 | 0.76 | TTR (0.53) | AURKAAURKBCOMTTTRCYP1A2 | |
| SCHEMBL6636066 | 0.76 | COMT (0.37) | AURKAAURKBCOMTTTRCYP1A2 | |
| SCHEMBL6632032 | 0.75 | AURKA (0.45) | AURKAAURKBCOMTTTRCYP1A2 | |
| SCHEMBL6633176 | 0.75 | TTR (0.50) | AURKAAURKBTTRCYP1A2ATIC | |
| SCHEMBL7894720 | 0.71 | AURKB (0.38) | AURKAAURKBCOMTTTRCYP1A2 | |
| SCHEMBL6632503 | 0.70 | NT5E (0.33) | TTRCYP1A2ATICTNNI3TNNT2 | |
| SCHEMBL9621075 | 0.70 | AURKA (0.42) | AURKAAURKBCOMTTTRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |