Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3190736 | 0.80 | CYP2C19 (0.48) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL3197683 | 0.80 | CYP2C19 (0.48) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL14463747 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL6492862 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL464008 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL124188 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL7192 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL6472876 | 0.78 | CYP2C19 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL3190448 | 0.76 | SIGMAR1 (0.47) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 | |
| SCHEMBL9580777 | 0.76 | TAAR1 (0.60) | CYP2C19HIF1AALDH1A1TAAR1ALOX15 |
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-5502204-A | REACTING WITH ETHYLENE OXIDE DERIVATIVE | NIHON BAYER AGROCHEM K.K. (JP) | 1996-03-26 | — | — | US | disclosed |