Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11827859 | 0.78 | CYP1A2 (0.44) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL4774786 | 0.76 | NPSR1 (0.42) | KMT2ATSHRMAPTLMNANPSR1 | |
| SCHEMBL587894 | 0.75 | ALDH1A1 (0.43) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL1003233 | 0.73 | TSHR (0.44) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL28163178 | 0.71 | CES1 (0.40) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL1653521 | 0.71 | CA2 (0.42) | TSHRMAPTNPSR1TDP1POLB | |
| SCHEMBL27597544 | 0.71 | TSHR (0.42) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL28800940 | 0.71 | TSHR (0.42) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL28065437 | 0.71 | TSHR (0.42) | KMT2ACYP1A2TSHRMAPTLMNA | |
| SCHEMBL1500738 | 0.71 | ALDH1A1 (0.42) | KMT2ACYP1A2TSHRMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1360174-A1 | PHENETHANOLAMINE DERIVATIVES FOR TREATMENT OF RESPIRATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2003-11-12 | — | — | EP | disclosed |
| WO-2002066422-A1 | PHENETHANOLAMINE DERIVATIVES FOR TREATMENT OF RESPIRATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2002-08-29 | — | — | WO | disclosed |