Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | ACACA | Q13085 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18201005 | 1.00 | CYP1A1 (0.41) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200788 | 0.99 | CYP1A1 (0.43) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18201016 | 0.99 | CYP1A1 (0.43) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200785 | 0.99 | CYP1A1 (0.43) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18201004 | 0.98 | CYP1A1 (0.44) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200512 | 0.98 | CYP1A1 (0.44) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200800 | 0.98 | CYP1A1 (0.41) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200513 | 0.98 | CYP1A1 (0.44) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200809 | 0.98 | CYP1A1 (0.41) | CYP1A1CYP1B1ACACAMEN1KMT2A | |
| SCHEMBL18200782 | 0.97 | CYP1A1 (0.43) | CYP1A1CYP1B1ACACAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3088392-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | Heesung Material Ltd. (KR) | 2016-11-02 | — | — | EP | disclosed |