Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | ARG1 | P05089 | 1/20 | 0.35 |
| ▸ | ARG2 | P78540 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7440502 | 0.88 | SMN1; SMN2 (0.45) | ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A | |
| SCHEMBL27420773 | 0.81 | ALDH1A1 (0.46) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9555264 | 0.80 | SMN1; SMN2 (0.45) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL12583561 | 0.77 | SMN1; SMN2 (0.47) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4396692 | 0.76 | SMN1; SMN2 (0.55) | ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A | |
| SCHEMBL4396691 | 0.76 | SMN1; SMN2 (0.55) | ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A | |
| Hydrochloric Acid SCHEMBL4398174 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A | |
| SCHEMBL9551389 | 0.75 | HTT (0.54) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL4398176 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A | |
| SCHEMBL9551388 | 0.75 | HTT (0.54) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1053246-B1 | BETA-SHEET MIMETICS AND METHODS RELATING TO THE USE THEREOF | MOLECUMETICS LTD (US) | 2003-01-02 | — | — | EP | disclosed |
| EP-1053246-A1 | BETA-SHEET MIMETICS AND METHODS RELATING TO THE USE THEREOF | MOLECUMETICS, LTD. (US) | 2000-11-22 | — | — | EP | disclosed |
| US-6020331-A | β-sheet mimetics and use thereof as protease inhibitors | MOLECUMETICS, LTD. (US) | 2000-02-01 | — | — | US | disclosed |
| WO-1999041276-A1 | β-SHEET MIMETICS AND METHODS RELATING TO THE USE THEREOF | MOLECUMETICS LTD. (US) | 1999-08-19 | — | — | WO | disclosed |
| EP-0915700-A1 | USE OF BETA-SHEET MIMETICS AS PROTEASE AND KINASE INHIBITORS AND AS INHIBITORS OF TRANSCRIPTION FACTORS | MOLECUMETICS, LTD. (US) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998005333-A1 | USE OF BETA-SHEET MIMETICS AS PROTEASE AND KINASE INHIBITORS AND AS INHIBITORS OF TRANSCRIPTION FACTORS | MOLECUMETICS LTD. (US) | 1998-02-12 | — | — | WO | disclosed |