Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 7/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL18873087 | 0.82 | MAPT (0.44) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL28073111 | 0.78 | RAB9A (0.52) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL7902071 | 0.75 | MAPT (0.48) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL28072960 | 0.75 | MAPT (0.49) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL13801141 | 0.74 | MAPT (0.51) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL28033963 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAPTKDM4ENPC1RAB9A | |
| SCHEMBL27307524 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL900790 | 0.72 | ALDH1A1 (0.56) | ALDH1A1MAPTKDM4ENPSR1NPC1 | |
| SCHEMBL12408964 | 0.72 | PDCD1 (0.38) | ALDH1A1MAPTKDM4ETSHRHSD17B10 | |
| SCHEMBL20349630 | 0.71 | RARA (0.37) | ALDH1A1MAPTKDM4EF2RL3NPC1 |
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-104987350-A | Chiral alpha-amino phosphonate ester compounds having anti-virus activity and containing benzothiazole heterocycle, preparation and applications thereof | UNIV GUIZHOU | 2015-10-21 | — | — | CN | disclosed |