Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | ESRRG | P62508 | 5/20 | 0.42 |
| ▸ | SLC13A5 | Q86YT5 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | ESRRB | O95718 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1864936 | 0.98 | TP53 (0.52) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL66122 | 0.98 | TP53 (0.52) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL1068676 | 0.86 | KCNH2 (0.53) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL30522104 | 0.85 | TP53 (0.45) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL5091992 | 0.84 | TP53 (0.79) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL13991700 | 0.81 | NPC1 (0.40) | TP53TSHRKCNH2GPR84LMNA | |
| SCHEMBL9671868 | 0.80 | HIF1A (0.37) | CA2LMNA | |
| SCHEMBL21176934 | 0.79 | ESR1 (0.39) | TP53TSHRKCNH2GPR84ESRRG | |
| SCHEMBL30536048 | 0.79 | RORC (0.38) | TP53TSHRKCNH2GPR84GRIA4 | |
| SCHEMBL3639494 | 0.79 | TSHR (0.57) | TP53TSHRKCNH2GPR84GRIA4 |
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-5015625-A | Methylenecyclohexane Carboxylates | FIRMENICH SA (CH) | 1991-05-14 | — | — | US | disclosed |