Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 3/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 5/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4655488 | 0.99 | CACNA1B (0.43) | EPHX1CACNA1BCYP19A1GAANAAA | |
| SCHEMBL1151670 | 0.78 | EPHX1 (0.41) | EPHX1CACNA1BCYP19A1GAAHTT | |
| SCHEMBL4628112 | 0.75 | PTPRB (0.43) | HTTSMN1; SMN2ALDH1A1KMT2AMEN1 | |
| SCHEMBL2252759 | 0.74 | EPHX1 (0.39) | EPHX1CACNA1BCYP19A1GAACTSS | |
| SCHEMBL2252762 | 0.74 | EPHX1 (0.39) | EPHX1CACNA1BCYP19A1GAACTSS | |
| SCHEMBL4079901 | 0.71 | EPHX1 (0.51) | EPHX1CACNA1BCYP19A1GAAHTT | |
| SCHEMBL27791244 | 0.71 | EPHX1 (0.51) | EPHX1CACNA1BCYP19A1GAAHTT | |
| SCHEMBL3434643 | 0.71 | EPHX1 (0.50) | EPHX1CYP19A1NAAAHTTNPC1 | |
| SCHEMBL14725806 | 0.71 | EPHX1 (0.50) | EPHX1CYP19A1NAAAHTTNPC1 | |
| SCHEMBL131561 | 0.71 | EPHX1 (0.50) | EPHX1CYP19A1NAAAHTTNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1877383-A1 | QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY | Chroma Therapeutics Limited (GB) | 2008-01-16 | — | — | EP | disclosed |
| WO-2006117552-A1 | QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY | CHROMA THERAPEUTICS LTD (GB) | 2006-11-09 | — | — | WO | disclosed |