Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.43 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | RXRG | P48443 | 1/20 | 0.42 |
| ▸ | LIFR | P42702 | 1/20 | 0.42 |
| ▸ | PTPRC | P08575 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7215469 | 0.82 | KDM4E (0.41) | NR4A2MAOAMAOBSMN1; SMN2ITGB1 | |
| SCHEMBL1010252 | 0.79 | MAOB (0.70) | NR4A2MAOAMAOBSMN1; SMN2 | |
| SCHEMBL10396460 | 0.76 | NR1H4 (0.62) | NR4A2MAOAMAOBSMN1; SMN2NR1H4 | |
| SCHEMBL27752503 | 0.72 | NR4A2 (0.70) | NR4A2MAOAMAOBSMN1; SMN2NR1H4 | |
| SCHEMBL3499309 | 0.72 | NR1H4 (0.58) | NR4A2SMN1; SMN2NR1H4ITGB1ITGA4 | |
| SCHEMBL6940065 | 0.71 | ITGB1 (0.57) | NR4A2SMN1; SMN2NR1H4ITGB1ITGA4 | |
| SCHEMBL366590 | 0.71 | SCN3A (0.50) | NR4A2MAOAMAOBSMN1; SMN2NR1H4 | |
| SCHEMBL7483584 | 0.71 | SMN1; SMN2 (0.69) | NR4A2SMN1; SMN2NR1H4 | |
| SCHEMBL8515211 | 0.71 | CES1 (0.52) | SMN1; SMN2ESR1CYP19A1 | |
| SCHEMBL13110148 | 0.70 | SMN1; SMN2 (0.59) | MAOBSMN1; SMN2NR1H4ITGB1ITGA4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6559179-B1 | Tinvention relates to the use of compounds as inhibitors of the fatty acid synthase FabH. | SMITHKLINE BEECHAM CORPORATION | 2003-05-06 | — | — | US | disclosed |