Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 2/20 | 0.60 |
| ▸ | GSK3B | P49841 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | NAT1 | P18440 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.36 |
| ▸ | MMP13 | P45452 | 3/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Rhodanine SCHEMBL2229918 | 0.78 | GSK3A (1.00) | GSK3AGSK3BALDH1A1CA2HPGD | |
| Rhodanine SCHEMBL94126 | 0.78 | — | — | |
| Rhodanine SCHEMBL55625 | 0.78 | — | — | |
| Catechol SCHEMBL2781528 | 0.77 | GSK3A (0.67) | GSK3AGSK3BALDH1A1NAT1CA2 | |
| Rhodanine SCHEMBL10704409 | 0.75 | — | — | |
| Rhodanine SCHEMBL11436580 | 0.75 | — | — | |
| Rhodanine SCHEMBL1461756 | 0.75 | — | — | |
| Rhodanine SCHEMBL8017015 | 0.75 | — | — | |
| Rhodanine SCHEMBL2403229 | 0.75 | — | — | |
| Rhodanine SCHEMBL5511180 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0621962-A1 | FUNCTIONALIZED MEROCYANINE DYES AND POLYMERS INCORPORATING SUCH DYES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1994-11-02 | — | — | EP | disclosed |
| US-5256784-A | Merocyanine dyes | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-10-26 | — | — | US | disclosed |
| WO-1993015596-A2 | FUNCTIONALIZED MEROCYANINE DYES AND POLYMERS INCORPORATING SUCH DYES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-08-05 | — | — | WO | disclosed |