Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | PTGIR | P43119 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15543683 | 0.85 | MAPT (0.38) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL15543685 | 0.85 | MAPT (0.38) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19069839 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MAPTCYP1A2CYP2C19HTT | |
| SCHEMBL10452571 | 0.83 | NPC1 (0.50) | ALDH1A1MAPTHTTTSHRLMNA | |
| SCHEMBL10452569 | 0.83 | NPC1 (0.50) | ALDH1A1MAPTHTTTSHRLMNA | |
| SCHEMBL10341391 | 0.83 | ABCC9 (0.45) | ALDH1A1MAPTHTTTSHRLMNA | |
| SCHEMBL4104086 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4535023 | 0.83 | ABCC9 (0.41) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL17402949 | 0.83 | ABCC9 (0.41) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL4092695 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MAPTCYP1A2CYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0625967-B1 | N,N'-SUBSTITUTED IMIDOCARBONIMIDIC DIAMIDES DERIVED FROM HYDROXYLAMINES | JACOBUS PHARMA CO INC (US) | 1997-08-27 | — | — | EP | disclosed |
| US-5322858-A | Antimicrobial, antiparasitic agents | JACOBUS PHARMACEUTICAL CO. INC. (US) | 1994-06-21 | — | — | US | disclosed |
| WO-1993016037-A1 | N,N'-SUBSTITUTED IMIDOCARBONIMIDIC DIAMIDES DERIVED FROM HYDROXYLAMINES | JACOBUS PHARMACEUTICAL CO., INC. (US) | 1993-08-19 | — | — | WO | disclosed |