Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 8/20 | 0.66 |
| ▸ | MEN1 | O00255 | 7/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 7/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8576721 | 0.89 | KMT2A (0.64) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL9168640 | 0.86 | KMT2A (0.74) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL8579681 | 0.83 | KMT2A (0.62) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL8577929 | 0.83 | KMT2A (0.70) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL8576289 | 0.82 | ADORA3 (0.56) | KMT2AADORA3 | |
| SCHEMBL9708443 | 0.82 | KMT2A (0.55) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL8581812 | 0.82 | KMT2A (0.67) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL6094064 | 0.81 | KMT2A (0.70) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL8606081 | 0.79 | KMT2A (0.66) | KMT2AMEN1POLBRAB9ATSHR | |
| SCHEMBL27523019 | 0.79 | KMT2A (0.63) | KMT2AMEN1POLBRAB9ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1043348-C | Asymmetrically substituted xanthines | BOEHRINGER INGELHEIM KG (DE) | 1999-05-12 | — | — | CN | disclosed |
| US-5719279-A | CHOLINOMIMETICS | BOEHRINGER INGELHEIM KG (DE) | 1998-02-17 | — | — | US | disclosed |
| WO-1994003456-A1 | ASYMMETRICALLY SUBSTITUTED XANTHINE WITH ADENOSINE-ANTAGONISTIC PROPERTIES | BOEHRINGER INGELHEIM KG (DE) | 1994-02-17 | — | — | WO | disclosed |