Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.43 |
| ▸ | TRPC4 | Q9UBN4 | 1/20 | 0.43 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.43 |
| ▸ | PYGL | P06737 | 1/20 | 0.41 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5100530 | 0.81 | CYP1A2 (0.57) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL5096961 | 0.81 | RAB9A (0.52) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13049808 | 0.80 | BCHE (0.66) | RAB9AALDH1A1NPC1POLBTDP1 | |
| SCHEMBL5103712 | 0.76 | CYP1A2 (0.51) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4151151 | 0.76 | HRH4 (0.47) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL28371344 | 0.74 | RAB9A (0.48) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL4159988 | 0.74 | RAB9A (0.48) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13733061 | 0.74 | SMN1; SMN2 (0.56) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11171719 | 0.73 | NPC1 (0.55) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL16342365 | 0.72 | RAB9A (0.45) | RAB9ACYP1A2CYP2D6CYP2C9CYP2C19 |
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-2008135526-A1 | CARBOXYLIC ACID AMIDES AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-11-13 | — | — | WO | disclosed |