Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 3/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 2/20 | 0.34 |
| ▸ | MMP13 | P45452 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP14 | P50281 | 1/20 | 0.34 |
| ▸ | MMP16 | P51512 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
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 SCHEMBL7405232 | 0.90 | PTGS2 (0.34) | MTNR1AMTNR1BPTGS2AKR1C3AKR1C2 | |
| Trifluoroacetic Acid SCHEMBL7402169 | 0.88 | MTNR1A (0.38) | MTNR1AMTNR1BLMNAKMT2AMEN1 | |
| Trifluoroacetic Acid SCHEMBL7313830 | 0.70 | PTGDR (0.45) | MTNR1AMTNR1BLMNAALDH1A1HTT | |
| Trifluoroacetic Acid SCHEMBL7307842 | 0.66 | PTGDR (0.43) | MTNR1AMTNR1BKMT2AMEN1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL7399152 | 0.64 | SIRT1 (0.45) | MTNR1AMTNR1B | |
| Trifluoroacetic Acid SCHEMBL7402879 | 0.64 | KDM1A (0.33) | — | |
| Trifluoroacetic Acid SCHEMBL27892361 | 0.59 | RAB9A (0.50) | KMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL27598900 | 0.59 | RAB9A (0.50) | KMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL7078665 | 0.58 | CA12 (0.46) | MMP9MMP2MMP1MMP13MMP3 | |
| SCHEMBL18205095 | 0.58 | CYP1A2 (0.49) | MTNR1AMTNR1BLMNAPTGS2ALDH1A1 |
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 |