Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | ASIC1 | P78348 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | AKT2 | P31751 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22086280 | 0.90 | RAB9A (0.45) | KIF11PTGESALOX5RAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL29137276 | 0.88 | RAB9A (0.44) | KIF11PTGESALOX5RAB9ANPC1 | |
| SCHEMBL17461052 | 0.85 | TSHR (0.48) | KIF11RAB9ANPC1KDM4EMEN1 | |
| SCHEMBL18372419 | 0.84 | KIF11 (0.48) | KIF11PTGESALOX5CYP19A1DHODH | |
| SCHEMBL17849332 | 0.84 | KIF11 (0.48) | KIF11PTGESALOX5CYP19A1DHODH | |
| SCHEMBL14447688 | 0.84 | KIF11 (0.48) | KIF11PTGESALOX5CYP19A1DHODH | |
| SCHEMBL16344297 | 0.84 | KIF11 (0.48) | KIF11PTGESALOX5CYP19A1DHODH | |
| SCHEMBL15372074 | 0.83 | ALDH1A1 (0.50) | KIF11KDM4EMEN1KMT2A | |
| SCHEMBL128222 | 0.83 | KIF11 (0.59) | KIF11CYP19A1DHODHRAB9ANPC1 | |
| SCHEMBL3421942 | 0.83 | KIF11 (0.59) | KIF11CYP19A1DHODHRAB9ANPC1 |
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-3369719-B1 | SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2020-02-26 | — | — | EP | disclosed |