Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.34 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14673301 | 0.87 | CNR2 (0.44) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| SCHEMBL102928 | 0.85 | TSHR (0.42) | ALDH1A1NPSR1TSHRMAPK1CNR2 | |
| Ammonia Solution, Strong SCHEMBL4465336 | 0.84 | TSHR (0.41) | ALDH1A1NPSR1TSHRMAPK1CNR2 | |
| SCHEMBL118309 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TSHRMAPK1CNR2L3MBTL1 | |
| SCHEMBL2089845 | 0.82 | KCNH2 (0.37) | ALDH1A1TSHRMAPK1CNR2 | |
| SCHEMBL18597669 | 0.82 | ALDH1A1 (0.35) | ALDH1A1NPSR1TSHRMAPK1MEN1 | |
| SCHEMBL19064329 | 0.78 | TSHR (0.50) | ALDH1A1TSHRMAPK1USP2CNR2 | |
| SCHEMBL10711575 | 0.78 | TSHR (0.50) | ALDH1A1TSHRMAPK1USP2CNR2 | |
| SCHEMBL24178220 | 0.76 | CALM1 (0.44) | ALDH1A1NPSR1TSHRMAPK1USP2 | |
| SCHEMBL18073542 | 0.76 | CALM1 (0.44) | ALDH1A1NPSR1TSHRMAPK1USP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1385619-A2 | SYSTEM FOR THE SYNTHESIS OF SPATIALLY SEPARATED LIBRARIES OF COMPOUNDS AND METHODS FOR THE USE THEREOF | Millennium Pharmaceuticals, Inc. (US) | 2004-02-04 | — | — | EP | disclosed |
| US-20030092064-A1 | Generation of preferential library; provide reaction aggregates, incubate each aggregate with chemical compound, monitor response at reaction aggregate | MILLENNIUM PHARMACEUTICALS, INC. | 2003-05-15 | — | — | US | disclosed |
| WO-2002081077-A2 | SYSTEM FOR THE SYNTHESIS OF SPATIALLY SEPARATED LIBRARIES OF COMPOUNDS AND METHODS FOR THE USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-10-17 | — | — | WO | disclosed |