Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27814942 | 0.82 | ALDH1A1 (0.43) | KMT2AMAPTSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL27793517 | 0.80 | PTGDR2 (0.42) | KMT2AMAPTSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL27651730 | 0.80 | CYP19A1 (0.37) | KMT2AMAPTRAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL27651789 | 0.79 | CYP19A1 (0.43) | KMT2AMAPTRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL27672015 | 0.77 | MEN1 (0.47) | KMT2AMAPTSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL28853255 | 0.75 | TSHR (0.36) | ALDH1A1LMNA | |
| SCHEMBL27843061 | 0.74 | SRD5A1 (0.38) | RAB9AALDH1A1NPC1LMNA | |
| SCHEMBL28185749 | 0.71 | RXRA (0.35) | — | |
| SCHEMBL28093247 | 0.71 | SRD5A1 (0.36) | KMT2AMAPTRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL28210348 | 0.71 | ALDH1A1 (0.45) | KMT2AHSD17B10MAPTRAB9AALDH1A1 |
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-105051033-B | Antiviral compound | 豪夫迈·罗氏有限公司 | 2018-02-16 | — | — | CN | disclosed |