Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11722203 | 0.91 | ALDH1A1 (0.68) | ALDH1A1KDM4ELMNAMAPTPOLB | |
| SCHEMBL11717438 | 0.79 | ALDH1A1 (0.75) | ALDH1A1KDM4ELMNAMAPTTDP1 | |
| SCHEMBL11717817 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNAMAPTTDP1 | |
| SCHEMBL11849818 | 0.77 | HPGD (0.44) | ALDH1A1KDM4ELMNAMAPTL3MBTL1 | |
| SCHEMBL11715395 | 0.77 | HPGD (0.44) | ALDH1A1KDM4ELMNAMAPTL3MBTL1 | |
| SCHEMBL11609081 | 0.76 | DRD2 (0.52) | ALDH1A1KDM4ELMNAMAPTPOLB | |
| SCHEMBL11716324 | 0.75 | ALDH1A1 (0.55) | ALDH1A1KDM4ELMNAMAPTPOLB | |
| SCHEMBL11718334 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMAPTPOLB | |
| SCHEMBL11719144 | 0.74 | ALDH1A1 (0.48) | ALDH1A1KDM4ELMNAMAPTPOLB | |
| SCHEMBL10508760 | 0.74 | ALDH1A1 (0.61) | ALDH1A1KDM4ELMNAMAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4036632-A | CONTROLLING WEEDS USING 3-METHYLTHIO-4-AMINO-6-BUTYL-1,2,4 TRIAZINE-5-ONE | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-19 | — | — | US | disclosed |
| US-3966715-A | 1,2,4-TRIAZINE-5-ONES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-06-29 | — | — | US | disclosed |
| US-3961936-A | SUBSTITUTED 1,2,4-TRIAZINE-5-ONES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-06-08 | — | — | US | disclosed |