Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS2 | P35228 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7803270 | 0.79 | NOS3 (0.41) | NOS3NOS1NOS2ALDH1A1KMT2A | |
| SCHEMBL24131411 | 0.79 | HSP90AA1 (0.37) | NOS3NOS1NOS2ALDH1A1KMT2A | |
| SCHEMBL18855163 | 0.78 | NOS3 (0.42) | NOS3NOS1NOS2TDP1MAPT | |
| SCHEMBL22113840 | 0.77 | TDP1 (0.35) | TDP1LMNATRPV1 | |
| SCHEMBL20609516 | 0.77 | TDP1 (0.40) | TDP1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL20689253 | 0.76 | NOS3 (0.39) | NOS3NOS1NOS2ALDH1A1KMT2A | |
| SCHEMBL3378717 | 0.76 | NOS3 (0.39) | NOS3NOS1NOS2ALDH1A1KMT2A | |
| SCHEMBL23766324 | 0.74 | POLB (0.34) | TDP1ALDH1A1KMT2AMAPTLMNA | |
| SCHEMBL20031355 | 0.74 | SSTR4 (0.42) | ALDH1A1MAPTTRPV1 | |
| SCHEMBL6029442 | 0.74 | KDM4E (0.54) | TDP1ALDH1A1KMT2AMAPTNPC1 |
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-3046927-B1 | POLYCYCLIC PHENYLPYRIDINE IRIDIUM COMPLEXES AND DERIVATIVES THEREOF FOR OLEDS | MERCK PATENT GMBH (DE) | 2019-01-30 | — | — | EP | disclosed |