Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | GRM8 | O00222 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11307661 | 0.84 | CES2 (0.45) | MAPTSMN1; SMN2CES2CES1HPGD | |
| SCHEMBL11016001 | 0.83 | TSHR (0.55) | SMN1; SMN2CES2CES1ALDH1A1OPRD1 | |
| SCHEMBL28276679 | 0.79 | ALDH1A1 (0.58) | MAPTSMN1; SMN2CES2CES1HPGD | |
| Benzene SCHEMBL5533098 | 0.79 | MAPT (0.75) | MAPTSMN1; SMN2CES2CES1HPGD | |
| SCHEMBL3140615 | 0.79 | KMT2A (0.45) | MAPTSMN1; SMN2HPGDLMNAALDH1A1 | |
| SCHEMBL2484883 | 0.79 | TSHR (0.59) | MAPTSMN1; SMN2ALDH1A1OPRD1RAB9A | |
| SCHEMBL16664376 | 0.79 | TSHR (0.59) | MAPTSMN1; SMN2ALDH1A1OPRD1RAB9A | |
| SCHEMBL595998 | 0.78 | MAPT (0.46) | MAPTSMN1; SMN2HPGDLMNAALDH1A1 | |
| SCHEMBL4018555 | 0.78 | CES2 (0.52) | CES2CES1RAB9ANPC1KMT2A | |
| SCHEMBL4076362 | 0.78 | CES2 (0.52) | SMN1; SMN2CES2CES1LMNAALDH1A1 |
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-2099776-A1 | CHELATING AGENT | Technische Universität München (DE) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008068516-A1 | CHELATING AGENT | Technische Universität München (DE) | 2008-06-12 | — | — | WO | disclosed |