Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL4609282 | 0.81 | PDPK1 (0.47) | PDPK1IDO1CYP11B2SIGMAR1 | |
| SCHEMBL30150914 | 0.74 | IDO1 (0.44) | PDPK1IDO1PIN1CYP11B2SIGMAR1 | |
| SCHEMBL2115194 | 0.74 | IDO1 (0.44) | PDPK1IDO1PIN1CYP11B2SIGMAR1 | |
| Ethane SCHEMBL9474214 | 0.69 | PDPK1 (0.52) | PDPK1IDO1MAOAMAOBCYP11B2 | |
| SCHEMBL57131 | 0.69 | IDO1 (0.50) | PDPK1IDO1PIN1MAOAMAOB | |
| SCHEMBL15147096 | 0.69 | HTR2A (0.57) | PDPK1IDO1MAOAMAOBCYP11B2 | |
| SCHEMBL1355960 | 0.69 | IDO1 (0.50) | PDPK1IDO1PIN1CYP11B2SIGMAR1 | |
| SCHEMBL186363 | 0.69 | HTR2A (0.57) | PDPK1IDO1MAOAMAOBCYP11B2 | |
| SCHEMBL21114381 | 0.69 | IDO1 (0.50) | PDPK1IDO1PIN1CYP11B2SIGMAR1 | |
| SCHEMBL3418678 | 0.69 | IDO1 (0.50) | PDPK1IDO1PIN1CYP11B2SIGMAR1 |
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-2008091594-A2 | FUNGICIDAL MIXTURES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-07-31 | — | — | WO | disclosed |