Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.63 |
| ▸ | CA1 | P00915 | 3/20 | 0.63 |
| ▸ | CA2 | P00918 | 3/20 | 0.63 |
| ▸ | CA9 | Q16790 | 3/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | MB | P02144 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11122026 | 0.90 | CA12 (0.73) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL31488242 | 0.86 | CA12 (0.59) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL6318825 | 0.85 | POLB (0.66) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL8518202 | 0.83 | CA12 (0.65) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL10967271 | 0.82 | TP53 (0.53) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL21847252 | 0.82 | ALDH1A1 (0.62) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL18789781 | 0.82 | CA12 (0.59) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL9206404 | 0.81 | CA12 (0.63) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL15651789 | 0.81 | CA1 (0.68) | CA12CA1CA2CA9CYP2C19 | |
| SCHEMBL9818903 | 0.81 | CA12 (0.63) | CA12CA1CA2CA9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5716446-A | PRINTING INK; TONERS; POWDER COATING | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-02-10 | — | — | US | disclosed |
| US-5698705-A | BASED ON AMINOBENZIMIDAZOLONES | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-16 | — | — | US | disclosed |
| US-4400507-A | FOR COLORING POLYMERS, LACQUERS | CIBA-GEIGY CORPORATION (US) | 1983-08-23 | — | — | US | disclosed |
| US-4262120-A | YELLOW TO ORANGE SHADES OF GOOD FASTNESS | CIBA-GEIGY CORPORATION (US) | 1981-04-14 | — | — | US | disclosed |