Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NCF1 | P14598 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 4/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.42 |
| ▸ | TYMS | P04818 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4704635 | 0.75 | KDM4E (0.54) | CYP1A2KDM4ELMNAPOLBMEN1 | |
| SCHEMBL9722805 | 0.72 | NR4A2 (0.47) | BCHEACHEGRIN1GRIN2ATYMS | |
| SCHEMBL9722807 | 0.72 | HTT (0.44) | APPBCHEACHEGRIN1GRIN2A | |
| SCHEMBL11195737 | 0.70 | KDM4E (0.52) | CYP1A2NCF1APPNQO2KDM4E | |
| SCHEMBL9722749 | 0.69 | G6PD (0.41) | KDM4ELMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL2929112 | 0.68 | KDM4E (0.60) | CYP1A2NCF1KDM4ELMNAMAPT | |
| SCHEMBL21596926 | 0.68 | MEN1 (0.48) | CYP1A2CYP3A4CYP2C19NCF1APP | |
| SCHEMBL4388241 | 0.68 | MAP4K4 (0.77) | CLK1MAPT | |
| SCHEMBL4199151 | 0.67 | MEN1 (0.57) | CYP1A2CYP3A4CYP2C19NCF1NQO2 | |
| SCHEMBL20748370 | 0.67 | CA1 (0.42) | CYP1A2CYP2C19KDM4ELMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5120872-A | Textile dyeing | CIBA-GEIGY CORPORATION (US) | 1992-06-09 | — | — | US | disclosed |
| US-4994563-A | Dyeing, printing cellulose, silk, wool, synthetic polyamides; colorfastness | CIBA-GEIGY CORPORATION (US) | 1991-02-19 | — | — | US | disclosed |
| EP-0349486-A2 | Azo dyes, their preparation and their use | CIBA-GEIGY AG (CH) | 1990-01-03 | — | — | EP | disclosed |