Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.48 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11414331 | 0.82 | GAA (0.47) | PTGS2GAAALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL10348335 | 0.79 | GAA (0.63) | PTGS2NOX1GAAALDH1A1MAPT | |
| SCHEMBL11277333 | 0.79 | MAPT (0.64) | NOX1GAAALDH1A1MAPTKDM4E | |
| SCHEMBL7043304 | 0.75 | GAA (0.64) | PTGS2NOX1GAAALDH1A1MAPT | |
| SCHEMBL11736145 | 0.72 | S1PR3 (0.42) | PTGS2NOX1GAAALDH1A1MAPT | |
| SCHEMBL9461871 | 0.72 | LMNA (0.50) | GAAALDH1A1MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL2384404 | 0.71 | CYP3A4 (0.63) | PTGS2GAAALDH1A1MAPTEPHX1 | |
| SCHEMBL1758402 | 0.71 | ALDH1A1 (0.46) | PTGS2GAAALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL11833343 | 0.71 | HPGD (0.64) | GAAALDH1A1MAPTKDM4EEPHX1 | |
| SCHEMBL9461862 | 0.70 | PTGS2 (0.67) | PTGS2GAAALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1077954-A1 | SUBSTITUTED 6-ARYL-3-THIOXO-5-(THI)OXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINES | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059983-A1 | SUBSTITUTED 6-ARYL-3-THIOXO-5-(THI)OXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINES | BASF AKTIENGESELLSCHAFT (DE) | 1999-11-25 | — | — | WO | disclosed |