Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3439959 | 0.89 | CA12 (0.44) | CA12CA1CA9CYP17A1MAPKAPK2 | |
| SCHEMBL2290216 | 0.87 | CA12 (0.45) | CA12CA1CA9CYP17A1IDO1 | |
| SCHEMBL6814479 | 0.86 | CA12 (0.44) | CA12CA1CA9CYP17A1IDO1 | |
| SCHEMBL6942064 | 0.86 | CA12 (0.44) | CA12CA1CA9CYP17A1IDO1 | |
| SCHEMBL7157865 | 0.85 | CYP17A1 (0.45) | CA12CA1CA9CYP17A1IDO1 | |
| SCHEMBL15177602 | 0.84 | CA12 (0.45) | CA12CA1CA9CYP17A1MAPKAPK2 | |
| SCHEMBL6681859 | 0.83 | KMT2A (0.43) | CA12CA1CA9CYP17A1IDO1 | |
| SCHEMBL16303890 | 0.82 | EPHX1 (0.58) | CA12CA1CA9NPC1HPGD | |
| SCHEMBL22941494 | 0.82 | CA12 (0.51) | CA12CA1CA9CYP17A1POLB | |
| SCHEMBL6814964 | 0.81 | MAPT (0.56) | CA12CA1CA9CYP17A1SMN1; 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-1999021831-A1 | TRICYCLIC COMPOUNDS AS CGMP-PDE INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1999-05-06 | — | — | WO | disclosed |