Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15022828 | 0.95 | TAAR1 (0.58) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL9870480 | 0.80 | CYP1A2 (0.46) | MAPTKDM4EKIF11CYP1A2CYP2D6 | |
| SCHEMBL10964126 | 0.80 | ALDH1A1 (0.60) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL29706002 | 0.80 | ALDH1A1 (0.60) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL10204874 | 0.79 | ALDH1A1 (0.50) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL13870182 | 0.77 | ALDH1A1 (0.63) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| Dimethylamine SCHEMBL5376380 | 0.76 | TAAR1 (0.61) | TAAR1ALDH1A1CYP3A4IDO1 | |
| SCHEMBL423630 | 0.76 | LMNA (0.51) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| Dimethylamine SCHEMBL9871526 | 0.75 | LMNA (0.71) | TAAR1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL10204873 | 0.74 | TAAR1 (0.53) | TAAR1ALDH1A1LMNAHPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5021429-A | Histamine h2-antagonists; antisecretory-antiallergen agent; skin disorders and peptic ulcers | ALLEN & HANSBURYS LIMITED (GB) | 1991-06-04 | — | — | US | disclosed |