Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 7/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | MLNR | O43193 | 1/20 | 0.49 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL3699 | 0.94 | KMT2A (0.52) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL3592 | 0.83 | CACNA2D1 (0.76) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL29420217 | 0.83 | CACNA2D1 (0.76) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL12342733 | 0.83 | CACNA2D1 (0.76) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL521869 | 0.83 | CACNA2D1 (0.76) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL521176 | 0.83 | CACNA2D1 (0.76) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| Hydrochloric Acid SCHEMBL3358201 | 0.82 | CACNA2D1 (0.74) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| Hydrochloric Acid SCHEMBL3280673 | 0.82 | CACNA2D1 (0.74) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| Oxalic Acid SCHEMBL3567 | 0.81 | CACNA2D1 (0.53) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A | |
| Phosphoric Acid SCHEMBL7768732 | 0.81 | CACNA2D1 (0.53) | CACNA2D1SLC6A4SLC6A2SLC6A3KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5023269-A | 3-aryloxy-3-substituted propanamines | ELI LILLY AND COMPANY (US) | 1991-06-11 | — | — | US | disclosed |
| US-4956388-A | ANTIDEPRESSANTS, ANTIANXIETY, TREATMENT OF OBESITY, ADDICTION TO SMOKING AND ALCOHOL | ELI LILLY AND COMPANY (US) | 1990-09-11 | — | — | US | disclosed |
| EP-0273658-A1 | 3-Aryloxy-3-substituted propanamines | ELI LILLY AND COMPANY (US) | 1988-07-06 | — | — | EP | disclosed |