Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XPO1 | O14980 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CDC25A | P30304 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 1/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8661726 | 0.91 | XPO1 (0.49) | XPO1HTTVKORC1MEN1KMT2A | |
| SCHEMBL3361792 | 0.79 | PTGS1 (0.42) | XPO1HTTVKORC1MEN1KMT2A | |
| SCHEMBL2961732 | 0.78 | XPO1 (0.44) | XPO1HTTMEN1KMT2ADHODH | |
| SCHEMBL1967302 | 0.78 | HTT (0.53) | XPO1HTTMEN1KMT2ADHODH | |
| SCHEMBL14201987 | 0.78 | XPO1 (0.41) | XPO1HTTVKORC1MEN1KMT2A | |
| SCHEMBL3682565 | 0.78 | XPO1 (0.51) | XPO1HTTCYP3A4HPGDCYP1A2 | |
| SCHEMBL11127533 | 0.77 | TSHR (0.43) | XPO1HTTVKORC1MEN1KMT2A | |
| SCHEMBL28041722 | 0.77 | XPO1 (0.42) | XPO1HTTVKORC1MEN1KMT2A | |
| SCHEMBL28251094 | 0.77 | IDO1 (0.45) | XPO1HTTMEN1KMT2ADHODH | |
| SCHEMBL28250552 | 0.77 | AKR1C3 (0.44) | XPO1HTTMEN1KMT2ADHODH |
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 |
|---|---|---|---|---|---|---|---|
| EP-2408447-A1 | PRENYLATED BISPHOSPHONATES AS ANTI-TUBERCULOSIS AGENTS | University of Iowa Research Foundation (US) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010108190-A1 | PRENYLATED BISPHOSPHONATES AS ANTI-TUBERCULOSIS AGENTS | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2010-09-23 | — | — | WO | disclosed |