Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1587165 | 0.78 | ALDH1A1 (0.35) | ALDH1A1HSD17B10TDP1HPGDCYP1A2 | |
| SCHEMBL6836179 | 0.77 | CYP1A2 (0.41) | CDK2ALDH1A1HSD17B10LMNATDP1 | |
| SCHEMBL1193683 | 0.77 | CYP1A2 (0.41) | CDK2ALDH1A1HSD17B10LMNATDP1 | |
| SCHEMBL2407426 | 0.70 | ALDH1A1 (0.35) | PTPN22ALDH1A1HSD17B10TDP1HPGD | |
| SCHEMBL10523695 | 0.69 | PTPN22 (0.41) | PTPN22ALDH1A1HSD17B10HPGDPOLB | |
| SCHEMBL5081659 | 0.68 | IDO1 (0.48) | PTPN22HSD17B10TDP1HPGDALOX15 | |
| SCHEMBL25021 | 0.68 | ALDH1A1 (0.50) | PTPN22ALDH1A1HSD17B10TDP1HPGD | |
| SCHEMBL6631773 | 0.68 | NQO2 (0.47) | ALDH1A1HPGDCA1CA2CYP1A2 | |
| SCHEMBL6482087 | 0.67 | ALDH1A1 (0.36) | ALDH1A1HSD17B10HPGDCYP1A2MCL1 | |
| SCHEMBL9276992 | 0.67 | CYP2A6 (0.41) | PTPN22ALDH1A1HSD17B10TDP1CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |