Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.46 |
| ▸ | SCD | O00767 | 1/20 | 0.46 |
| ▸ | VNN1 | O95497 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20591090 | 0.94 | SCD (0.50) | YTHDC1SCDDRD2TBXA2RCYP11B2 | |
| SCHEMBL20591091 | 0.88 | SCD (0.46) | YTHDC1SCDCYP11B2RAB9AMEN1 | |
| SCHEMBL28895492 | 0.86 | PKM (0.58) | YTHDC1SCDDRD2TBXA2RCYP11B2 | |
| SCHEMBL20591084 | 0.83 | PKM (0.47) | YTHDC1SCDCYP11B2RAB9AKMT2A | |
| SCHEMBL20591093 | 0.82 | CYP11B2 (0.48) | CYP11B2MEN1KMT2ACYP11B1PKM | |
| SCHEMBL20591088 | 0.82 | CYP11B2 (0.48) | YTHDC1CYP11B2MEN1KMT2ACYP11B1 | |
| SCHEMBL4150352 | 0.82 | PKM (0.62) | CYP11B2CYP11B1PKMGAATSHR | |
| SCHEMBL20591094 | 0.81 | NOTUM (0.49) | YTHDC1SCDPKMGAATSHR | |
| SCHEMBL20591078 | 0.81 | GAA (0.48) | YTHDC1KMT2APKMGAATSHR | |
| SCHEMBL20591075 | 0.80 | MAPK8 (0.48) | YTHDC1CYP11B2PKMGAATSHR |
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-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| US-5753664-A | ANTITUMOR AGENTS, PYRIMIDONES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |