Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28885803 | 1.00 | KMT2A (0.52) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL17595505 | 0.88 | MAPK1 (0.59) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL12869027 | 0.85 | ALDH1A1 (0.56) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL1415776 | 0.82 | KMT2A (0.56) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL8939993 | 0.81 | ALDH1A1 (0.64) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL4712246 | 0.80 | MAPK1 (0.55) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL9450052 | 0.79 | KMT2A (0.54) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL23382100 | 0.79 | MAPK1 (0.54) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL4136160 | 0.79 | MAPK1 (0.54) | KMT2AMAPK1ALDH1A1MAPTRAB9A | |
| SCHEMBL18063410 | 0.79 | KMT2A (0.56) | KMT2AMAPK1ALDH1A1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110770224-B | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2022-11-18 | — | — | CN | disclosed |