Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K8 | P41279 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.37 |
| ▸ | VNN1 | O95497 | 1/20 | 0.36 |
| ▸ | GALR1 | P47211 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GALR2 | O43603 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5029255 | 0.91 | GALR1 (0.46) | MAP3K8DRD2VNN1GALR1KDM4E | |
| SCHEMBL5551996 | 0.87 | GALR1 (0.47) | DRD2GALR1GALR2CA2DRD1 | |
| SCHEMBL6231894 | 0.87 | MAP3K8 (0.40) | MAP3K8DRD2VNN1GALR1KDM4E | |
| SCHEMBL6239105 | 0.83 | HTT (0.44) | MAP3K8VNN1KDM4EALDH1A1POLB | |
| SCHEMBL4832495 | 0.83 | DRD2 (0.50) | DRD2GALR1GALR2DRD3 | |
| SCHEMBL4829744 | 0.83 | DRD2 (0.50) | DRD2GALR1GALR2DRD3 | |
| SCHEMBL4836437 | 0.80 | GALR1 (0.48) | DRD2GALR1GALR2DRD3 | |
| SCHEMBL14294122 | 0.80 | GALR1 (0.49) | MAP3K8DRD2VNN1GALR1KDM4E | |
| SCHEMBL5031357 | 0.80 | GALR1 (0.54) | DRD2GALR1GALR2 | |
| SCHEMBL5031374 | 0.79 | GALR1 (0.41) | MAP3K8DRD2GALR1GALR2CA2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004026844-A9 | METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS | REDDY US THERAPEUTICS INC (US) | 2004-11-11 | — | — | WO | claimed |