Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.64 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | BCR | P11274 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2516130 | 0.85 | DHODH (0.53) | RXRAMMP2XDHMAP4K4EGLN2 | |
| SCHEMBL14150399 | 0.82 | RXRA (0.69) | RXRACYP3A4SMN1; SMN2HSD17B1HSD17B2 | |
| SCHEMBL30420728 | 0.82 | RXRA (0.69) | RXRACYP3A4SMN1; SMN2HSD17B1HSD17B2 | |
| SCHEMBL16195103 | 0.81 | DHODH (0.56) | RXRASMN1; SMN2PTGER4XDHMAP4K4 | |
| SCHEMBL2958179 | 0.81 | RXRA (0.68) | RXRAABL1ABCB1BCRHSD17B1 | |
| SCHEMBL2558136 | 0.81 | RXRA (0.73) | RXRAMAPTSMN1; SMN2ABL1ABCB1 | |
| SCHEMBL933732 | 0.80 | RXRA (0.51) | RXRA | |
| SCHEMBL2561821 | 0.79 | RXRA (0.64) | RXRAXDHABL1ABCB1BCR | |
| SCHEMBL2035502 | 0.79 | RXRA (1.00) | RXRAMAP4K4ABL1ABCB1BCR | |
| SCHEMBL7157751 | 0.79 | RXRA (0.68) | RXRASMN1; SMN2MAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012083145-A1 | GLUCOSAMINE DERIVATIVES | GLAXO WELLCOME MANUFACTURING PTE LTD (SG) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012083145-A1 | GLUCOSAMINE DERIVATIVES | GLAXO WELLCOME MANUFACTURING PTE LTD (SG) | 2012-06-21 | — | — | WO | disclosed |