Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | GPR3 | P46089 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8674604 | 0.87 | ACHE (0.41) | ACHEBCHECYP1A2TSHRMEN1 | |
| Bromide SCHEMBL8677362 | 0.87 | ACHE (0.41) | ACHEBCHECYP1A2TSHRMEN1 | |
| SCHEMBL6675793 | 0.79 | ACHE (0.43) | ACHEBCHECYP1A2TSHRMEN1 | |
| Hydrochloric Acid SCHEMBL8676695 | 0.76 | ACHE (0.46) | ACHEBCHECYP1A2TSHRGPR3 | |
| Iodide SCHEMBL8677405 | 0.76 | ACHE (0.46) | ACHEBCHECYP1A2TSHRPOLB | |
| Bromide SCHEMBL8673699 | 0.76 | ACHE (0.46) | ACHEBCHECYP1A2TSHRGPR3 | |
| SCHEMBL12259780 | 0.76 | CYP1A2 (0.42) | ACHEBCHECYP1A2TSHRMEN1 | |
| Hydrochloric Acid SCHEMBL8674744 | 0.76 | ACHE (0.41) | ACHEBCHECYP1A2TSHRMEN1 | |
| Hydrochloric Acid SCHEMBL8674748 | 0.76 | ACHE (0.41) | ACHEBCHECYP1A2TSHRMEN1 | |
| Hydrochloric Acid SCHEMBL8673661 | 0.75 | ACHE (0.43) | ACHEBCHECYP1A2TSHRMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1404325-A2 | METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY | GUILFORD PHARMACEUTICALS INC. (US) | 2004-04-07 | — | — | EP | disclosed |
| WO-2002096420-A2 | METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY | GUILFORD PHARMACEUTICALS INC. (US) | 2002-12-05 | — | — | WO | disclosed |