Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 4/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 9/20 | 0.43 |
| ▸ | RAB9A | P51151 | 9/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
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 SCHEMBL7511293 | 0.99 | PNMT (0.43) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| SCHEMBL7506573 | 0.86 | PNMT (0.46) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| Hydrochloric Acid SCHEMBL7506643 | 0.85 | PNMT (0.45) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| SCHEMBL7511436 | 0.83 | MAPT (0.39) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| Hydrochloric Acid SCHEMBL7510690 | 0.82 | MAPT (0.38) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| SCHEMBL7510203 | 0.80 | NPC1 (0.42) | NPC1RAB9AMAPTNFKB1NFKB2 | |
| SCHEMBL8187523 | 0.79 | NPC1 (0.47) | NPC1RAB9AMAPTNFKB1NFKB2 | |
| SCHEMBL7816919 | 0.78 | NOS3 (0.54) | PNMTADRA2AADRA2BADRA2CNPC1 | |
| SCHEMBL7510861 | 0.78 | RAB9A (0.44) | NPC1RAB9AMAPTNFKB1NFKB2 | |
| SCHEMBL8192682 | 0.76 | MAPT (0.43) | NPC1RAB9AMAPTNFKB1NFKB2 |
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-0861250-B1 | AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2002-02-13 | — | — | EP | claimed |