Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | CA4 | P22748 | 1/20 | 0.57 |
| ▸ | CA7 | P43166 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LCK | P06239 | 2/20 | 0.54 |
| ▸ | METAP1 | P53582 | 2/20 | 0.53 |
| ▸ | USP8 | P40818 | 2/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | PRKACA | P17612 | 1/20 | 0.53 |
| ▸ | PRKACG | P22612 | 1/20 | 0.53 |
| ▸ | PRKACB | P22694 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2252533 | 1.00 | CA1 (0.57) | CA1CA2CA4CA7CA9 | |
| SCHEMBL10885799 | 0.96 | CA1 (0.53) | CA1CA2CA4CA7CA9 | |
| SCHEMBL8076766 | 0.95 | CA1 (0.57) | CA1CA2CA4CA7CA9 | |
| SCHEMBL7786812 | 0.95 | CA1 (0.57) | CA1CA2CA4CA7CA9 | |
| SCHEMBL30629120 | 0.95 | CA1 (0.57) | CA1CA2CA4CA7CA9 | |
| 2-Methoxyanthraquinone SCHEMBL222927 | 0.94 | PTPN1 (0.60) | CA1CA2CA4CA7CA9 | |
| SCHEMBL4645032 | 0.92 | PTPN1 (0.58) | CA1CA2CA4CA7CA9 | |
| SCHEMBL2993382 | 0.91 | CA1 (0.53) | CA1CA2CA4CA7CA9 | |
| SCHEMBL23111388 | 0.91 | CA1 (0.57) | CA1CA2CA4CA7CA9 | |
| SCHEMBL28155812 | 0.91 | CA1 (0.57) | CA1CA2CA4CA7CA9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1163372-A4 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | PRINCETON SEPARATIONS (US) | 2002-10-02 | — | — | EP | claimed |
| EP-1163372-A1 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | Princeton Separations (US) | 2001-12-19 | — | — | EP | claimed |
| WO-2000056933-A1 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | PRINCETON SEPARATIONS (US) | 2000-09-28 | — | — | WO | claimed |
| EP-3801507-A2 | TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION | ETH Zurich (CH) | 2021-04-14 | — | — | EP | disclosed |
| EP-1163372-A4 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | PRINCETON SEPARATIONS (US) | 2002-10-02 | — | — | EP | disclosed |
| EP-1163372-A1 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | Princeton Separations (US) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000056933-A1 | CHEMICALLY REACTIVE PLANE-RIGIDIZED CYANINE DYES AND THEIR DERIVATIVES | PRINCETON SEPARATIONS (US) | 2000-09-28 | — | — | WO | disclosed |