Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 3/20 | 0.54 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
| ▸ | JAK1 | P23458 | 1/20 | 0.48 |
| ▸ | TDO2 | P48775 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ARHGDIA | P52565 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9850498 | 0.85 | BCHE (0.49) | NOS1JAK2JAK1TDO2TRPV1 | |
| SCHEMBL10668370 | 0.81 | DRD2 (0.62) | JAK2JAK1TDO2TRPV1CLK4 | |
| SCHEMBL18669085 | 0.80 | NOS1 (0.60) | NOS1JAK2JAK1TDO2TRPV1 | |
| SCHEMBL9850437 | 0.80 | HTR1A (0.61) | JAK2JAK1TDO2 | |
| SCHEMBL11115106 | 0.78 | ADRB1 (0.45) | NOS1KMT2AMAPTDRD2DRD4 | |
| SCHEMBL7574499 | 0.77 | JAK2 (0.52) | NOS1JAK2JAK1TDO2CLK4 | |
| SCHEMBL9850419 | 0.77 | JAK2 (0.44) | JAK2JAK1TDO2TRPV1MEN1 | |
| SCHEMBL7572136 | 0.77 | JAK2 (0.55) | NOS1JAK2JAK1TDO2CLK4 | |
| SCHEMBL17738840 | 0.76 | PKM (0.53) | JAK2JAK1TDO2TRPV1CLK4 | |
| Hydrochloric Acid SCHEMBL9850389 | 0.74 | ALDH1A1 (0.58) | TRPV1MEN1KMT2AMAPTALDH1A1 |
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-0443862-A1 | Triamine derivatives and their acid-addition salts | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1991-08-28 | — | — | EP | disclosed |