Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 11/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27338541 | 0.79 | MEN1 (0.36) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL27319971 | 0.76 | ALDH1A1 (0.42) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL16880352 | 0.72 | SMN1; SMN2 (0.58) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL464610 | 0.72 | SMN1; SMN2 (0.58) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL13451946 | 0.71 | HPGD (0.47) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL2212148 | 0.70 | MTOR (0.57) | MTORPIK3CA | |
| SCHEMBL30799027 | 0.69 | ALDH1A1 (0.45) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL10735070 | 0.69 | KMT2A (0.85) | ALDH1A1MEN1CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL12035535 | 0.69 | CHRM5 (0.46) | ALDH1A1SMN1; SMN2PDE5APDE4APDE4B | |
| SCHEMBL31258998 | 0.68 | MAPK9 (0.52) | ALDH1A1MEN1CYP3A4KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1412338-B1 | 1,3,5-TRIAZINE-2,4,6-TRIONES, PREPARATION AND USE AS GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS | NEUROCRINE BIOSCIENCES INC (US) | 2006-01-18 | — | — | EP | disclosed |
| EP-1412338-A1 | 1,3,5-TRIAZINE-2,4,6-TRIONES, PREPARATION AND USE AS GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS | Neurocrine Biosciences, Inc. (US) | 2004-04-28 | — | — | EP | disclosed |
| WO-2003011839-A1 | 1,3,5-TRIAZINE-2,4,6-TRIONES, PREPARATION AND USE AS GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS | NEUROCRINE BIOSCIENCES, INC. (US) | 2003-02-13 | — | — | WO | disclosed |