Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.68 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.68 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.68 |
| ▸ | HTR6 | P50406 | 6/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7089878 | 0.89 | CHRNB2 (0.55) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL3886866 | 0.88 | HTR6 (0.63) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| Hydrochloric Acid SCHEMBL275390 | 0.87 | HTR6 (0.61) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| Cyanide SCHEMBL28564062 | 0.86 | CHRNB2 (0.52) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL20281778 | 0.86 | CHRNB2 (0.71) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL9300309 | 0.83 | HTR6 (0.49) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL5463620 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL21790166 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL27683744 | 0.81 | HTR6 (0.50) | CHRNB2CHRNA7CHRNA4HTR6MEN1 | |
| SCHEMBL14193990 | 0.81 | CHRNB2 (0.64) | CHRNB2CHRNA7CHRNA4HTR6MEN1 |
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-1071664-A1 | SUBSTITUTED 2-OXO-ALKANOIC ACID- 2-(INDOL-3-YL)-ETHYL] AMIDES | BAYER AG (DE) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999054301-A1 | SUBSTITUTED 2-OXO-ALKANOIC ACID-[2-(INDOL-3-YL)-ETHYL] AMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-10-28 | — | — | WO | disclosed |