Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965726 | 0.89 | NPC1 (0.45) | BLMMAPTSMN1; SMN2KMT2ALMNA | |
| SCHEMBL14966280 | 0.87 | SMN1; SMN2 (0.52) | MAPTSMN1; SMN2KMT2ACA12CA1 | |
| SCHEMBL14965955 | 0.87 | MAPK1 (0.44) | MAPTSMN1; SMN2CA12CA1CA2 | |
| SCHEMBL14965906 | 0.85 | PANK3 (0.42) | MAPTSMN1; SMN2LMNAHTTFAAH | |
| SCHEMBL14965755 | 0.79 | EPHX2 (0.50) | — | |
| SCHEMBL14965586 | 0.77 | EPHX2 (0.51) | MAPT | |
| SCHEMBL14965703 | 0.76 | SMN1; SMN2 (0.49) | MAPTSMN1; SMN2LMNAALDH1A1HTT | |
| SCHEMBL14966078 | 0.76 | PKM (0.52) | MAPTSMN1; SMN2KMT2ALMNAMEN1 | |
| SCHEMBL14965637 | 0.76 | CHRM1 (0.51) | — | |
| SCHEMBL14965373 | 0.75 | CA1 (0.48) | MAPTSMN1; SMN2KMT2ACA1CA2 |
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-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | claimed |