Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL11655212 | 0.86 | SMN1; SMN2 (0.41) | ALDH1A1MAPTSMN1; SMN2TDP1NPC1 | |
| Hydrochloric Acid SCHEMBL11655456 | 0.84 | SMN1; SMN2 (0.41) | ALDH1A1MAPTSMN1; SMN2TDP1NPC1 | |
| SCHEMBL11657715 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPTSMN1; SMN2TDP1MAPK1 | |
| Hydrochloric Acid SCHEMBL11659587 | 0.82 | ALDH1A1 (0.42) | ALDH1A1MAPTSMN1; SMN2TDP1MAPK1 | |
| SCHEMBL11662468 | 0.81 | CYP2C9 (0.47) | ALDH1A1CYP2D6CYP2C9MAPTTDP1 | |
| SCHEMBL11661309 | 0.81 | S100B (0.44) | ALDH1A1MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL11652170 | 0.81 | NOS3 (0.40) | ALDH1A1MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL11659361 | 0.80 | MAPT (0.40) | ALDH1A1CYP2D6CYP2C9MAPTRAB9A | |
| SCHEMBL11660469 | 0.80 | MEN1 (0.44) | ALDH1A1MAPTSMN1; SMN2TDP1MAPK1 | |
| Hydrochloric Acid SCHEMBL11654418 | 0.79 | MAPT (0.40) | ALDH1A1CYP2D6CYP2C9MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4073636-A | Azolylamidine compounds and herbicidal compositions | BAYER AKTIENGESELLSCHAFT (DT) | 1978-02-14 | — | — | US | disclosed |
| US-3993469-A | Azolylamidine compounds and herbicidal compositions | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-23 | — | — | US | disclosed |