Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | HTR1A | P08908 | 1/20 | 0.61 |
| ▸ | THPO | P40225 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | F13A1 | P00488 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL50338 | 0.83 | BCAT2 (0.68) | NPC1KDM4ETAAR1SMN1; SMN2BCAT2 | |
| SCHEMBL885089 | 0.83 | BCAT2 (0.68) | NPC1KDM4ETAAR1SMN1; SMN2BCAT2 | |
| SCHEMBL885090 | 0.83 | BCAT2 (0.68) | NPC1KDM4ETAAR1SMN1; SMN2BCAT2 | |
| SCHEMBL8379019 | 0.83 | TAAR1 (0.58) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 | |
| SCHEMBL3649469 | 0.83 | TAAR1 (0.58) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 | |
| SCHEMBL8379013 | 0.83 | TAAR1 (0.58) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 | |
| SCHEMBL16157282 | 0.82 | TAAR1 (0.53) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 | |
| SCHEMBL9510562 | 0.81 | ACACB (0.54) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 | |
| Acetic Acid SCHEMBL8330086 | 0.81 | BCAT2 (0.66) | NPC1KDM4ETAAR1SMN1; SMN2BCAT2 | |
| SCHEMBL2440641 | 0.81 | HIF1A (0.56) | NPC1KDM4ETAAR1HIF1ASMN1; SMN2 |
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-2016012333-A1 | PESTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2016-01-28 | — | — | WO | disclosed |