Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL10879814 | 1.00 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTHPGDMAOA | |
| SCHEMBL10880568 | 0.86 | MAOA (0.58) | ALDH1A1KDM4EMAPTHPGDMAOA | |
| SCHEMBL10881146 | 0.85 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTHPGDMAOA | |
| SCHEMBL10879784 | 0.83 | MAPT (0.55) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL10880892 | 0.77 | RXRA (0.41) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL10880896 | 0.77 | RXRA (0.41) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL8676133 | 0.77 | RXRA (0.42) | ALDH1A1KDM4EMAOAMAOBPOLB | |
| SCHEMBL10883172 | 0.76 | FAAH (0.41) | ALDH1A1HPGDLMNAMEN1KMT2A | |
| SCHEMBL10881168 | 0.76 | ACHE (0.42) | ALDH1A1KDM4EMAPTHPGDMAOA | |
| SCHEMBL9489485 | 0.76 | MAOA (0.66) | HPGDMAOAMAOBPOLBL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4500545-A | HYPOTENSIVE, ANTISECRETORY AGENTS, AND DOPAMINE ANTAGONIST | ELI LILLY AND COMPANY (US) | 1985-02-19 | — | — | US | disclosed |
| US-4448990-A | Hydroxyaminotetralincarboxamides | ELI LILLY AND COMPANY (US) | 1984-05-15 | — | — | US | disclosed |