Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CXCR3 | P49682 | 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 | |
|---|---|---|---|---|
| SCHEMBL9892996 | 0.86 | ALDH1A1 (0.44) | ALDH1A1KDM4EALOX15KMT2AHSD17B10 | |
| SCHEMBL16480424 | 0.82 | ALDH1A1 (0.45) | ALDH1A1KDM4EALOX15KMT2AHSD17B10 | |
| SCHEMBL9891860 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4EALOX15KMT2AHSD17B10 | |
| SCHEMBL9892995 | 0.75 | CNR1 (0.50) | ALDH1A1KDM4EKMT2AMAPTHPGD | |
| SCHEMBL9107770 | 0.75 | KMT2A (0.46) | ALDH1A1KDM4EALOX15KMT2AHSD17B10 | |
| SCHEMBL9107760 | 0.75 | KMT2A (0.46) | ALDH1A1KDM4EALOX15KMT2AHSD17B10 | |
| SCHEMBL9893169 | 0.73 | FFAR1 (0.46) | ALDH1A1KDM4ECHRNB1CHRNB2CHRNB4 | |
| SCHEMBL83529 | 0.70 | CUL4A (0.49) | ALDH1A1KDM4EKMT2AMAPTHPGD | |
| SCHEMBL15849381 | 0.70 | KMT2A (0.42) | ALDH1A1KMT2AMAPTHPGDMEN1 | |
| SCHEMBL12263172 | 0.69 | OPRK1 (0.39) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010077836-A2 | PYRROLIDINE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-07-08 | — | — | WO | disclosed |