Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | EIF4E | P06730 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | F11 | P03951 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.32 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.32 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.32 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7402879 | 0.92 | KDM1A (0.33) | HCRTR1HCRTR2EIF4EPTGDR2 | |
| Trifluoroacetic Acid SCHEMBL7403856 | 0.90 | PTGDR2 (0.40) | HCRTR1HCRTR2ADRA2CPTGDR2DPP4 | |
| Trifluoroacetic Acid SCHEMBL7315970 | 0.72 | CCR2 (0.41) | — | |
| Trifluoroacetic Acid SCHEMBL7316949 | 0.66 | ABCB11 (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL7399632 | 0.64 | MTNR1A (0.36) | MMP12MMP13 | |
| Trifluoroacetic Acid SCHEMBL7314734 | 0.64 | AR (0.38) | MMP12MMP13 | |
| Trifluoroacetic Acid SCHEMBL7312753 | 0.64 | MDM2 (0.39) | PTGDR2MMP12MMP13PTPN5 | |
| Trifluoroacetic Acid SCHEMBL3750230 | 0.64 | FFAR1 (0.49) | ADRA2C | |
| Trifluoroacetic Acid SCHEMBL6379652 | 0.63 | TAAR1 (0.68) | — | |
| Trifluoroacetic Acid SCHEMBL7402169 | 0.61 | MTNR1A (0.38) | MMP12MMP13 |
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-2001034146-A1 | NOVEL ANTI-INFECTIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2001-05-17 | — | — | WO | claimed |
| WO-2001034146-A1 | NOVEL ANTI-INFECTIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2001-05-17 | — | — | WO | disclosed |