Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 7/20 | 0.41 |
| ▸ | MAOB | P27338 | 6/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.41 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22136958 | 0.88 | SLC18A3 (0.54) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| SCHEMBL430336 | 0.88 | SLC18A3 (0.54) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| SCHEMBL430023 | 0.88 | SLC18A3 (0.54) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| SCHEMBL51322 | 0.88 | SLC18A3 (0.54) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| Hydrochloric Acid SCHEMBL4040775 | 0.86 | SLC18A3 (0.52) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| Hydrochloric Acid SCHEMBL15319877 | 0.86 | SLC18A3 (0.52) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| Hydrochloric Acid SCHEMBL10849250 | 0.86 | SLC18A3 (0.52) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| Hydrochloric Acid SCHEMBL4534403 | 0.84 | SLC18A3 (0.50) | SLC18A3SIGMAR1KDM1AMAOBMAOA | |
| SCHEMBL8520147 | 0.82 | SLC18A3 (0.50) | SLC18A3SIGMAR1GRIN2BCYP2D6CYP2C19 | |
| SCHEMBL7549602 | 0.82 | SLC18A3 (0.50) | SLC18A3SIGMAR1GRIN2BCYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3093328-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-06-13 | — | — | EP | disclosed |