Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 2/20 | 0.31 |
| ▸ | ACHE | P22303 | 2/20 | 0.31 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5151745 | 0.80 | NPC1 (0.32) | NPC1RAB9ANOTUM | |
| SCHEMBL8492431 | 0.80 | CYP2C19 (0.34) | S1PR2CYP2C19 | |
| Bromide SCHEMBL7429002 | 0.78 | NPC1 (0.32) | NPC1RAB9ANOTUM | |
| SCHEMBL3961367 | 0.72 | CES2 (0.46) | CYP2C19ALDH1A1MAPK1NPC1RAB9A | |
| SCHEMBL2854030 | 0.72 | NOTUM (0.32) | NOTUM | |
| SCHEMBL7849512 | 0.71 | NPC1 (0.54) | S1PR2CYP2C19SMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL7452550 | 0.71 | F2 (0.41) | NPC1RAB9ALMNA | |
| SCHEMBL148063 | 0.70 | — | — | |
| SCHEMBL7443656 | 0.70 | GSK3B (0.43) | SMN1; SMN2ALDH1A1NPC1RAB9AKCNH2 | |
| SCHEMBL1857158 | 0.69 | — | — |
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-1999037636-A1 | HETEROCYCLYL-DERIVATIVES | NIHON BAYER AGROCHEM K.K. (DE) | 1999-07-29 | — | — | WO | disclosed |