Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 5/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.38 |
| ▸ | MGMT | P16455 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | ATP4A | P20648 | 2/20 | 0.35 |
| ▸ | ATP4B | P51164 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17887717 | 0.73 | NOS1 (0.41) | NOS1NOS2 | |
| SCHEMBL8219698 | 0.71 | CHRNA7 (0.45) | NOS1HTR7ALDH1A1TSHRCHRNB2 | |
| SCHEMBL23278119 | 0.71 | ALDH1A1 (0.47) | NOS1HTR7ALDH1A1TSHRCHRNB2 | |
| SCHEMBL25320228 | 0.70 | ALDH1A1 (0.37) | NOS1PARP1HTR7ALDH1A1TSHR | |
| SCHEMBL13655362 | 0.68 | CHRNB2 (0.51) | CHRNB2CHRNA4 | |
| SCHEMBL989636 | 0.67 | ALDH1A1 (0.67) | NOS1HTR7ALDH1A1TSHRCHRNB2 | |
| SCHEMBL309116 | 0.66 | ALDH1A1 (0.54) | NOS1HTR7ALDH1A1TSHRNOS2 | |
| SCHEMBL8844212 | 0.66 | HTR2C (0.46) | — | |
| Hydrochloric Acid SCHEMBL5913208 | 0.65 | MAOA (0.53) | NOS1HTR7ALDH1A1TSHRNOS2 | |
| Hydrochloric Acid SCHEMBL3863134 | 0.65 | MAOA (0.53) | NOS1HTR7ALDH1A1TSHRNOS2 |
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-2009123753-A1 | INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES | NORTH CAROLINA STATE UNIVERSITY (US) | 2009-10-08 | — | — | WO | disclosed |