Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 10/20 | 0.48 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL28579825 | 0.89 | XDH (0.50) | XDHPTGER1USP2TSHRKDM4E | |
| SCHEMBL28589919 | 0.82 | XDH (0.45) | XDHPTGER1KDM4EPKMALDH1A1 | |
| SCHEMBL28587011 | 0.81 | XDH (0.45) | XDHPTGER1KDM4EPKMLMNA | |
| SCHEMBL28579824 | 0.81 | XDH (0.46) | XDHPTGER1USP2TSHRCYP1A2 | |
| SCHEMBL28570870 | 0.80 | XDH (0.54) | XDHPTGER1KDM4EPKMALDH1A1 | |
| SCHEMBL28574651 | 0.80 | XDH (0.47) | XDHPTGER1 | |
| SCHEMBL28575823 | 0.76 | XDH (0.45) | XDHPTGER1USP2TSHRCYP1A2 | |
| SCHEMBL28914642 | 0.76 | XDH (0.45) | XDHPTGER1USP2TSHRCYP1A2 | |
| SCHEMBL28583440 | 0.72 | XDH (0.59) | XDHPTGER1 | |
| SCHEMBL28846504 | 0.66 | ALDH1A1 (0.50) | PTGER1TSHRCYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112979559-A | 2-phenyl pyrimidine formic acid derivative and preparation method and application thereof | 沈阳药科大学 | 2021-06-18 | — | — | CN | claimed |
| CN-112979559-A | 2-phenyl pyrimidine formic acid derivative and preparation method and application thereof | 沈阳药科大学 | 2021-06-18 | — | — | CN | disclosed |