Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 11/20 | 0.44 |
| ▸ | RAB9A | P51151 | 10/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | HPGDS | O60760 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8866347 | 0.89 | RAB9A (0.46) | ALDH1A1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL8866652 | 0.86 | SUV39H2 (0.45) | ALDH1A1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL8867199 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL4590288 | 0.82 | PTGS1 (0.42) | KDM4EKMT2ARXFP1RAB9APOLB | |
| SCHEMBL506934 | 0.77 | ANPEP (0.45) | ALDH1A1MEN1KMT2ASMN1; SMN2MAPT | |
| SCHEMBL8866424 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL8866648 | 0.75 | NR4A2 (0.42) | ALDH1A1KDM4EKMT2AALDH1A3NPC1 | |
| SCHEMBL8867560 | 0.74 | ALDH1A1 (0.48) | ALDH1A1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL2129032 | 0.71 | ALDH1A1 (0.73) | ALDH1A1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL8866307 | 0.71 | SUV39H2 (0.46) | ALDH1A1KDM4ENPC1RAB9APOLB |
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-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |