Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MMP13 | P45452 | 6/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 4/20 | 0.38 |
| ▸ | MMP1 | P03956 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1134062 | 0.87 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2MMP13F2PRSS1 | |
| SCHEMBL1133836 | 0.87 | MMP13 (0.46) | ALDH1A1SMN1; SMN2MMP13F2PRSS1 | |
| SCHEMBL2194247 | 0.77 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2MMP13POLBMMP2 | |
| SCHEMBL2194245 | 0.72 | MMP13 (0.46) | ALDH1A1SMN1; SMN2MMP13POLBMMP2 | |
| SCHEMBL5908693 | 0.72 | PLCG1 (0.47) | ALDH1A1SMN1; SMN2POLBLMNAKMT2A | |
| SCHEMBL16103058 | 0.70 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2MMP13F2PRSS1 | |
| SCHEMBL7017241 | 0.70 | KMT2A (0.54) | ALDH1A1POLBMMP2LMNAHTT | |
| SCHEMBL19450297 | 0.69 | MMP2 (0.56) | ALDH1A1SMN1; SMN2MMP13POLBMMP2 | |
| SCHEMBL5908893 | 0.69 | CA12 (0.44) | ALDH1A1SMN1; SMN2MMP13POLBMMP2 | |
| SCHEMBL6608349 | 0.68 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2POLBMEN1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2285759-A1 | RADIOLABELLED MMP SELECTIVE COMPOUNDS | Academisch Medisch Centrum bij de Universiteit van Amsterdam (NL) | 2011-02-23 | — | — | EP | disclosed |