Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20415330 | 0.82 | KMT2A (0.55) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL10061827 | 0.80 | KMT2A (0.57) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL9150262 | 0.78 | ALDH1A1 (0.66) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL20018334 | 0.77 | TSHR (0.57) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL28958798 | 0.74 | ALDH1A1 (0.55) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL3492756 | 0.74 | TSHR (0.57) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL11455170 | 0.74 | KMT2A (0.55) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL6269137 | 0.74 | ALDH1A1 (0.70) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL18930108 | 0.73 | TSHR (0.47) | ALDH1A1KMT2AMAPTPOLBTSHR | |
| SCHEMBL25937749 | 0.73 | SMN1; SMN2 (0.51) | ALDH1A1KMT2AMAPTPOLBTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9920042-B2 | Compounds for use in the treatment of mycobacterial infections | UNIVERSITE DE DROIT ET DE LA SANTE DE LILLE 2 (FR) | 2018-03-20 | — | — | US | disclosed |