Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 7/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 3/20 | 0.45 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8154122 | 1.00 | CNR2 (0.47) | CNR2TDP1HDAC6CYP2C19CNR1 | |
| SCHEMBL7884421 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL124701 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL8579335 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL9408477 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL8579332 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL141631 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL7884419 | 0.93 | TDP1 (0.51) | CNR2TDP1HDAC6ESRRGHSD11B1 | |
| SCHEMBL10111286 | 0.92 | CYP2C19 (0.58) | CNR2CYP2C19CNR1ESRRG | |
| SCHEMBL8581948 | 0.89 | TDP1 (0.48) | CNR2TDP1HDAC6ESRRGHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6150065-A | 1-(P-AMINOPHENYL)-1,4,4-TRIPHENYLBUTADIENE DERIVATIVE CHARGE TRANSFER COMPOUNDS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2000-11-21 | — | — | US | disclosed |