Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | NOS1 | P29475 | 4/20 | 0.44 |
| ▸ | PRMT6 | Q96LA8 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SLC11A2 | P49281 | 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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL9872444 | 0.80 | TAAR1 (0.53) | CYP1A2CYP2D6CYP2C19CYP3A4KDM4E | |
| SCHEMBL1697126 | 0.78 | MAPT (0.64) | NOS1PRMT6CYP3A4KDM4EMAPT | |
| SCHEMBL15022828 | 0.77 | TAAR1 (0.58) | CYP1A2CYP2D6CYP2C19CYP3A4KDM4E | |
| SCHEMBL9872439 | 0.77 | ACHE (0.53) | CYP1A2CYP2D6CYP2C19NOS1PRMT6 | |
| SCHEMBL3363042 | 0.76 | NOS1 (0.53) | NOS1PRMT6CYP3A4KDM4EMAPT | |
| SCHEMBL30125422 | 0.76 | NOS1 (0.53) | NOS1PRMT6CYP3A4KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL10955274 | 0.75 | ACHE (0.51) | CYP1A2CYP2D6CYP2C19NOS1PRMT6 | |
| Hydrochloric Acid SCHEMBL3273205 | 0.75 | MAPT (0.68) | NOS1PRMT6CYP3A4KDM4EMAPT | |
| SCHEMBL11745386 | 0.74 | TAAR1 (0.58) | CYP1A2CYP2D6CYP2C19KIF11TP53 | |
| SCHEMBL15023253 | 0.74 | IDO1 (0.47) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 |
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 4 patents. 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 |
| US-4496567-A | HSITAMINE H2 ANTAGONISTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1985-01-29 | — | — | US | disclosed |
| EP-0013071-A1 | Pyrimidinone derivatives, processes for preparing them and pharmaceutical compositions containing them | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1980-07-09 | — | — | EP | disclosed |
| WO-1980000966-A1 | NEW HISTAMINE H2-ANTAGONISTS | SMITH KLINE FRENCH LAB (GB) | 1980-05-15 | — | — | WO | disclosed |