Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL897268 | 0.81 | ALDH1A1 (0.49) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL7879918 | 0.78 | ADRA2A (0.45) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL16195622 | 0.74 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL28935895 | 0.74 | ALDH1A1 (0.50) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL26090923 | 0.74 | ADRA2A (0.44) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL24590618 | 0.72 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL10383937 | 0.72 | ADRA2A (0.31) | ADRA2AADRA2BADRA2CSMN1; SMN2 | |
| SCHEMBL26089915 | 0.71 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL12437558 | 0.71 | ALDH1A1 (0.42) | ALDH1A1HPGDKMT2AMEN1KDM4E | |
| SCHEMBL23209724 | 0.70 | ALDH1A1 (0.49) | ADRA2AADRA2BADRA2CALDH1A1HPGD |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4894480-A | Phenyl substituted-2,4,6,8-nonatetraenoic acid | HOFFMANN-LA ROCHE INC. (US) | 1990-01-16 | — | — | US | disclosed |
| US-4883613-A | TREATMENT OF RHEUMATOID ARTHRITIS, IMMUNOSUPPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1989-11-28 | — | — | US | disclosed |
| US-4883614-A | TREATMENT OF RHEUMATOID ARTHRITIS, IMMUNOSUPPRESSANTS | HOFFMAN-LA ROCHE INC. (US) | 1989-11-28 | — | — | US | disclosed |
| US-4780251-A | ANTIRHEUMATIC AGENTS, IMMUNOSUPPRESSANTS | HOFFMAN-LA ROCHE INC. (US) | 1988-10-25 | — | — | US | disclosed |
| EP-0169571-B1 | PHENYLNONATETRAENIC-ACID DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1988-03-09 | — | — | EP | disclosed |
| US-4648996-A | ANTIRHEUMATIC AGENTS, IMMUNOSUPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1987-03-10 | — | — | US | disclosed |
| EP-0169571-A1 | Phenylnonatetraenic-acid derivatives, their preparation and pharmaceutical compositions containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1986-01-29 | — | — | EP | disclosed |