Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7068812 | 0.88 | NOS1 (0.40) | KDM1AMAOBTAAR1SLC6A2NOS1 | |
| SCHEMBL7688066 | 0.84 | MAOA (0.35) | KDM1AMAOBRAB9ANPC1SLC6A2 | |
| SCHEMBL3389545 | 0.76 | NOS1 (0.46) | KDM1AMAOBTAAR1ALDH1A1SLC6A2 | |
| Isomiosamine SCHEMBL18003636 | 0.68 | CHRNB2 (0.50) | MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2 | |
| Isomiosamine SCHEMBL30215730 | 0.68 | CHRNB2 (0.50) | MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2 | |
| Isomiosamine SCHEMBL24979951 | 0.68 | CHRNB2 (0.50) | MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL15757454 | 0.68 | NPC1 (0.70) | KDM1AMAOBRAB9ANPC1ALDH1A1 | |
| SCHEMBL442267 | 0.67 | CYP2C19 (0.33) | KDM1AMAOBMEN1KMT2ASLC6A2 | |
| SCHEMBL31596808 | 0.66 | KDM1A (0.61) | KDM1AMAOBTAAR1RAB9ANPC1 | |
| Ammonia Solution, Strong SCHEMBL2454353 | 0.66 | NPC1 (0.68) | KDM1AMAOBRAB9ANPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002081489-A1 | PALLADIUM-COMPLEXES BASED ON PYRROLINE-METAL COMPLEXES | BAYER CROPSCIENCE AG (DE) | 2002-10-17 | — | — | WO | disclosed |