Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.39 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14620051 | 0.82 | EPHX1 (0.35) | EPHX1ADRA2AADRA1ACYP2D6ADRA1D | |
| SCHEMBL14620035 | 0.75 | CEL (0.33) | — | |
| SCHEMBL8070410 | 0.72 | HAO1 (0.52) | EPHX1ADRA2AADRA1ACYP2D6ADRA1D | |
| SCHEMBL14620064 | 0.70 | EPHX1 (0.39) | EPHX1ADRA2AADRA1ACYP2D6ADRA1D | |
| SCHEMBL3668028 | 0.67 | ADRA2A (0.54) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL11696770 | 0.66 | IDO1 (0.51) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL14620038 | 0.66 | CEL (0.32) | ADRA1A | |
| SCHEMBL28844169 | 0.66 | GID4 (0.51) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL29842306 | 0.66 | GID4 (0.62) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL395087 | 0.66 | GID4 (0.62) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007003520-A1 | FLUORESCENT DIKETOPYRROLOPYRROLES AND DERIVATIVES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2007-01-11 | — | — | WO | disclosed |