Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21971755 | 0.91 | KDM1A (0.40) | TAAR1HSD17B10CYP3A4TDP1ALDH1A1 | |
| SCHEMBL21971757 | 0.85 | TP53 (0.39) | CYP3A4ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL21972685 | 0.85 | MMP3 (0.44) | TDP1NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL21971029 | 0.83 | ALDH1A1 (0.34) | TAAR1HSD17B10ALDH1A1KDM1AMAOB | |
| SCHEMBL21971030 | 0.83 | ACHE (0.33) | TAAR1TDP1KDM4EMAPTKDM1A | |
| SCHEMBL21971736 | 0.83 | ALDH1A1 (0.38) | TAAR1HSD17B10CYP3A4NPC1RAB9A | |
| SCHEMBL21971699 | 0.83 | KDM1A (0.33) | TAAR1TDP1KDM4EMAPTKDM1A | |
| SCHEMBL21971123 | 0.83 | ESR1 (0.41) | KDM1AMAOB | |
| SCHEMBL21971768 | 0.83 | ESR1 (0.41) | KDM1AMAOB | |
| SCHEMBL21972687 | 0.82 | ALDH1A1 (0.37) | HSD17B10CYP3A4NPC1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20200144518-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2020-05-07 | — | — | US | disclosed |