Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.51 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.51 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8364646 | 1.00 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTNR4A1NR4A2 | |
| SCHEMBL4285935 | 1.00 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTNR4A1NR4A2 | |
| SCHEMBL8364933 | 0.82 | MAPT (0.73) | ALDH1A1KDM4EMAPTCES2CES1 | |
| SCHEMBL8364930 | 0.82 | MAPT (0.73) | ALDH1A1KDM4EMAPTCES2CES1 | |
| SCHEMBL15428914 | 0.82 | NR4A1 (0.60) | ALDH1A1KDM4EMAPTNR4A1NR4A2 | |
| SCHEMBL8042647 | 0.82 | CA12 (0.60) | NR4A1NR4A2NR4A3CES2CES1 | |
| SCHEMBL8042651 | 0.82 | CA12 (0.60) | NR4A1NR4A2NR4A3CES2CES1 | |
| SCHEMBL8368077 | 0.80 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTCES2CES1 | |
| SCHEMBL8368078 | 0.80 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTCES2CES1 | |
| SCHEMBL14342663 | 0.80 | KDM4E (0.74) | ALDH1A1KDM4EMAPTMEN1GAA |
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-5925768-A | ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS | SANOFI (FR) | 1999-07-20 | — | — | US | disclosed |