Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.48 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.47 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL29246079 | 0.86 | FLT3 (0.46) | CYP1A2CYP2A6LMNAHTTSMN1; SMN2 | |
| SCHEMBL2328909 | 0.80 | CYP1A2 (0.76) | CYP1A2CYP2A6LMNAHTTSMN1; SMN2 | |
| Anisole SCHEMBL4551224 | 0.80 | CA4 (0.56) | HTTCA1CA2PPARG | |
| Anthracene SCHEMBL21332717 | 0.80 | PTPN1 (0.43) | CYP1A2CYP2A6LMNASMN1; SMN2CA1 | |
| Anthracene SCHEMBL27569591 | 0.80 | PTPN1 (0.43) | CYP1A2CYP2A6LMNASMN1; SMN2CA1 | |
| Methyl Alcohol SCHEMBL5664821 | 0.80 | CYP1A2 (0.91) | CYP1A2CYP2A6LMNAHTTSMN1; SMN2 | |
| Naphthalene SCHEMBL7160995 | 0.80 | ALOX12 (0.42) | CYP2A6LMNASMN1; SMN2L3MBTL1CA1 | |
| Naphthalene SCHEMBL29233861 | 0.80 | ALOX12 (0.42) | CYP2A6LMNASMN1; SMN2L3MBTL1CA1 | |
| SCHEMBL112792 | 0.80 | CYP1A2 (1.00) | CYP1A2CYP2A6LMNAHTTSMN1; SMN2 | |
| SCHEMBL29353188 | 0.80 | CYP1A2 (1.00) | CYP1A2CYP2A6LMNAHTTSMN1; SMN2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109843856-A | KRAS G12C inhibitor | 米拉蒂治疗股份有限公司 | 2019-06-04 | — | — | CN | disclosed |
| EP-2186801-A2 | Intermediates for synthesizing dibenzorhodamine dyes | Applera Corporation (US) | 2010-05-19 | — | — | EP | disclosed |
| EP-1339798-A2 | SULFONATED DIARYLRHODAMINE DYES | Applera Corporation (US) | 2003-09-03 | — | — | EP | disclosed |
| WO-2002044416-A2 | SULFONATED DIARYLRHODAMINE DYES AS FLUORESCENT LABELS | APPLERA CORPORATION (US) | 2002-06-06 | — | — | WO | disclosed |
| EP-1034221-A1 | DIBENZORHODAMINE DYES USEFUL AS FLUORESCENT LABELLING AGENTS | THE PERKIN-ELMER CORPORATION (US) | 2000-09-13 | — | — | EP | disclosed |
| WO-1999027020-A1 | DIBENZORHODAMINE DYES USEFUL AS FLOURESCENT LABELLING AGENTS | THE PERKIN-ELMER CORPORATION (US) | 1999-06-03 | — | — | WO | disclosed |