Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.30 |
| ▸ | TUBB | P07437 | 1/20 | 0.30 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.30 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.30 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.30 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.30 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.30 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.30 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.30 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.30 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24432600 | 0.76 | DHFR (0.31) | DHFR | |
| SCHEMBL12047901 | 0.75 | SIGMAR1 (0.51) | SIGMAR1L3MBTL1DHFR | |
| SCHEMBL24066476 | 0.75 | — | — | |
| SCHEMBL13177377 | 0.74 | SIGMAR1 (0.41) | ALDH1A1KMT2ASIGMAR1L3MBTL1KDM4E | |
| SCHEMBL12047903 | 0.73 | SIGMAR1 (0.50) | ALDH1A1SIGMAR1L3MBTL1KDM4EMAPT | |
| SCHEMBL21004214 | 0.73 | SIGMAR1 (0.43) | ALDH1A1KMT2ASIGMAR1L3MBTL1 | |
| SCHEMBL12700459 | 0.73 | SIGMAR1 (0.46) | ALDH1A1KMT2ASIGMAR1DHFR | |
| SCHEMBL21098281 | 0.73 | SIGMAR1 (0.43) | ALDH1A1KMT2ASIGMAR1L3MBTL1 | |
| SCHEMBL12047918 | 0.72 | SIGMAR1 (0.46) | ALDH1A1SIGMAR1DHFR | |
| SCHEMBL23561665 | 0.72 | MAPT (0.39) | ALDH1A1KMT2AL3MBTL1KDM4ELMNA |
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-1794258-B1 | NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME(4) | LG CHEMICAL LTD (KR) | 2010-09-01 | — | — | EP | disclosed |