Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.39 |
| ▸ | NPC1 | O15118 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 10/20 | 0.38 |
| ▸ | LMNA | P02545 | 7/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7552145 | 0.99 | MAPT (0.38) | MAPTNPC1RAB9AKMT2AMEN1 | |
| SCHEMBL7816919 | 0.79 | NOS3 (0.54) | MAPTNPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL8177595 | 0.79 | NPC1 (0.50) | MAPTNPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL6602320 | 0.78 | MAPT (0.45) | MAPTNPC1RAB9AKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL5385363 | 0.77 | MAPT (0.44) | MAPTNPC1RAB9AKMT2AMEN1 | |
| SCHEMBL7550693 | 0.76 | LMNA (0.36) | MAPTNPC1RAB9AKMT2AMEN1 | |
| SCHEMBL7482734 | 0.76 | NPC1 (0.48) | MAPTNPC1RAB9AKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL7556779 | 0.76 | LMNA (0.35) | MAPTNPC1RAB9AKMT2AMEN1 | |
| SCHEMBL19405165 | 0.75 | NOS1 (0.55) | CYP2D6 | |
| Hydrochloric Acid SCHEMBL7483114 | 0.75 | NPC1 (0.47) | MAPTNPC1RAB9AKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0861250-B1 | AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2002-02-13 | — | — | EP | claimed |
| US-6140322-A | Amidine and isothiourea derivatives as inhibitors of nitric oxide synthase | ASTRA AKTIEBOLAG (SE) | 2000-10-31 | — | — | US | claimed |