Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.45 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.42 |
| ▸ | MITF | O75030 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10873294 | 0.81 | MC4R (0.50) | ALDH1A1LMNAMEN1KMT2AHTT | |
| SCHEMBL1625535 | 0.80 | SMN1; SMN2 (0.64) | ALDH1A1TSHRMEN1KMT2AMAPT | |
| SCHEMBL14965615 | 0.80 | MEP1B (0.50) | ALDH1A1MEN1KMT2AHTTSMN1; SMN2 | |
| SCHEMBL14376096 | 0.80 | LMNA (0.46) | ALDH1A1LMNAMEN1KMT2AHTT | |
| SCHEMBL1779582 | 0.78 | CHRM2 (0.68) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL3117530 | 0.77 | DAO (0.47) | ALDH1A1LMNAMEN1KMT2AHTT | |
| SCHEMBL1780636 | 0.77 | PPARG (0.51) | ALDH1A1LMNAMEN1KMT2AHTT | |
| Hydrochloric Acid SCHEMBL27669851 | 0.76 | CHRM2 (0.66) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL2997202 | 0.76 | LMNA (0.48) | ALDH1A1LMNAMEN1KMT2AHTT | |
| SCHEMBL4573411 | 0.76 | LMNA (0.51) | ALDH1A1LMNAMEN1KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |