Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2630537 | 0.80 | HPGD (0.40) | ALDH1A1HPGDMAPTLMNANPC1 | |
| SCHEMBL27062672 | 0.76 | FAAH (0.33) | ALDH1A1HPGDMAPTLMNANPC1 | |
| SCHEMBL18214479 | 0.75 | EPHX1 (0.37) | CA1CA2FAAH | |
| SCHEMBL10891429 | 0.75 | ALDH1A1 (0.40) | ALDH1A1LMNAHSD17B10CA1CA2 | |
| SCHEMBL24926317 | 0.75 | FAAH (0.36) | HPGDKDM4ECA2FAAHRELA | |
| SCHEMBL2197372 | 0.74 | FAAH (0.43) | HPGDKDM4ECA2FAAHRELA | |
| SCHEMBL14217269 | 0.74 | EPHX1 (0.39) | ALDH1A1HPGDMAPTLMNANPC1 | |
| SCHEMBL13164464 | 0.73 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL10642859 | 0.72 | TSHR (0.33) | ALDH1A1HPGDMAPTLMNANPC1 | |
| SCHEMBL1728031 | 0.71 | ALDH1A1 (0.42) | ALDH1A1 |
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-9938236-B2 | Antiviral agents against HBV infection | DREXEL UNIVERSITY (US) | 2018-04-10 | — | — | US | disclosed |