Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 2/20 | 0.41 |
| ▸ | KCNJ5 | P48544 | 2/20 | 0.41 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL7920537 | 0.78 | MAPT (0.46) | ALDH1A1KDM4EMAPTMAPK1BLM | |
| SCHEMBL7922641 | 0.72 | MAPT (0.61) | ALDH1A1KDM4EMAPTMAPK1BLM | |
| SCHEMBL7922651 | 0.69 | ALDH1A1 (0.59) | ALDH1A1KDM4EMAPTMAPK1BLM | |
| SCHEMBL14096406 | 0.69 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPTMAPK1BLM | |
| SCHEMBL7922643 | 0.68 | TASP1 (0.62) | ALDH1A1KDM4EMAPTMAPK1POLB | |
| SCHEMBL19538024 | 0.68 | POLB (0.55) | ALDH1A1KDM4EMAPTPOLBKMT2A | |
| SCHEMBL14096409 | 0.66 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTMAPK1BLM | |
| SCHEMBL7922259 | 0.65 | TASP1 (0.61) | ALDH1A1KDM4EMAPTMAPK1POLB | |
| SCHEMBL38655969 | 0.63 | KMO (0.48) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL8215669 | 0.63 | HPGD (0.70) | ALDH1A1KDM4EMAPTPOLBKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1100500-A1 | THE USE OF CD4-BINDING SMALL MOLECULES TO INHIBIT HIV INFECTION | THOMAS JEFFERSON UNIVERSITY (US) | 2001-05-23 | — | — | EP | claimed |
| WO-2000004903-A1 | THE USE OF CD4-BINDING SMALL MOLECULES TO INHIBIT HIV INFECTION | THOMAS JEFFERSON UNIVERSITY (US) | 2000-02-03 | — | — | WO | claimed |
| EP-1100500-A1 | THE USE OF CD4-BINDING SMALL MOLECULES TO INHIBIT HIV INFECTION | THOMAS JEFFERSON UNIVERSITY (US) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000004903-A1 | THE USE OF CD4-BINDING SMALL MOLECULES TO INHIBIT HIV INFECTION | THOMAS JEFFERSON UNIVERSITY (US) | 2000-02-03 | — | — | WO | disclosed |