Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 4/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19327337 | 0.85 | ATM (0.49) | MEN1KMT2AATMDRD2HTR2C | |
| SCHEMBL19327316 | 0.68 | ATM (0.50) | MEN1KMT2AATMDRD2HTR2C | |
| SCHEMBL19327318 | 0.68 | ATM (0.50) | MEN1KMT2AATMDRD2HTR2C | |
| SCHEMBL19327311 | 0.68 | ATM (0.56) | MEN1KMT2AATMDRD2HTR2C | |
| SCHEMBL19327277 | 0.66 | ATM (0.47) | MEN1KMT2AATMHTR2CSIGMAR1 | |
| SCHEMBL19327278 | 0.66 | ATM (0.47) | MEN1KMT2AATMHTR2CSIGMAR1 | |
| SCHEMBL12017418 | 0.65 | ATM (0.63) | MEN1KMT2AATMDRD2DRD3 | |
| SCHEMBL19327293 | 0.65 | ATM (0.63) | MEN1KMT2AATMDRD2DRD3 | |
| SCHEMBL19327326 | 0.65 | ROCK2 (0.53) | MEN1KMT2AATMCYP2C19SIGMAR1 | |
| SCHEMBL7865825 | 0.65 | DRD2 (0.62) | SLC18A3DRD2DRD3HTR3EHTR3B |
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-2017156239-A1 | COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-09-14 | — | — | WO | disclosed |