Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL329169 | 1.00 | KMT2A (0.40) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL5862723 | 1.00 | KMT2A (0.40) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL17093234 | 0.85 | KMT2A (0.37) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL17093415 | 0.85 | KMT2A (0.37) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL9469474 | 0.85 | MAPK1 (0.38) | POLBMAPTMAPK1CYP3A4SMN1; SMN2 | |
| SCHEMBL11132699 | 0.84 | KDM1A (0.42) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL11245264 | 0.83 | KMT2A (0.43) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL14968052 | 0.82 | HTT (0.45) | KMT2ANPSR1POLBL3MBTL1MAPT | |
| SCHEMBL9750486 | 0.80 | EDNRA (0.43) | L3MBTL1MAPTSMN1; SMN2MAOBTSHR | |
| SCHEMBL8776894 | 0.80 | EDNRA (0.43) | L3MBTL1MAPTSMN1; SMN2MAOBTSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111440155-B | Chrysamide B derivative with anti-tumor activity and preparation and application thereof | 兰州大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-111004225-A | Novel piperazine compound and preparation method and application thereof | 兰州大学 | 2020-04-14 | — | — | CN | disclosed |
| US-7060471-B2 | Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2006-06-13 | — | — | US | disclosed |