Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7265202 | 0.83 | ALDH1A1 (0.80) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL6176115 | 0.81 | GAA (0.49) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL10187288 | 0.77 | ALDH1A1 (0.80) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL6925643 | 0.76 | GAA (0.46) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL7403010 | 0.76 | SMN1; SMN2 (0.50) | ALDH1A1MAPTHTTCYP19A1LMNA | |
| SCHEMBL7404286 | 0.76 | KDM4E (0.45) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL1130003 | 0.75 | KDM4E (0.57) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL21663432 | 0.75 | ALDH1A1 (0.46) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL9570228 | 0.74 | ALDH1A1 (0.96) | ALDH1A1GAAKDM4EMAPTTSHR | |
| SCHEMBL31098523 | 0.74 | GAA (0.82) | ALDH1A1GAAKDM4EMAPTTSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5801170-A | Heterocyclic biphenylylamides useful as 5HT1D antagonists | SMITHKLINE BEECHAM PLC (GB) | 1998-09-01 | — | — | US | disclosed |
| EP-0733048-A1 | HETEROCYCLIC BIPHENYLYLAMIDES USEFUL AS 5HT1D ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-09-25 | — | — | EP | disclosed |
| WO-1995015954-A1 | HETEROCYCLIC BIPHENYLYLAMIDES USEFUL AS 5HT1D ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-06-15 | — | — | WO | disclosed |