Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 5/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10333434 | 0.81 | KDM4E (0.39) | CNR2ALDH1A1CYP1A2CYP2C19LMNA | |
| SCHEMBL10333453 | 0.79 | TNF (0.37) | TNFCNR2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL10333850 | 0.71 | CNR2 (0.35) | CNR2ALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL9195065 | 0.69 | ALDH1A1 (0.43) | CNR2ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL10332847 | 0.68 | CYP1A2 (0.42) | CNR2ALDH1A1CYP1A2CYP2C19GAA | |
| SCHEMBL4251804 | 0.66 | TNF (0.56) | TNF | |
| SCHEMBL9196053 | 0.66 | ALDH1A1 (0.44) | ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL9202880 | 0.65 | P2RX3 (0.49) | — | |
| SCHEMBL10559207 | 0.65 | P2RX3 (0.49) | — | |
| SCHEMBL9202886 | 0.63 | ALDH1A1 (0.38) | TNFALDH1A1CYP1A2CYP2C19KDM4E |
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-4912104-A | Containing ketone group in position 2 and 4 of ring | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-03-27 | — | — | US | disclosed |
| EP-0306185-A1 | Tricyclic fused pyrimidine derivatives their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-03-08 | — | — | EP | disclosed |