Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1007970 | 0.77 | CA2 (0.65) | CA2HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL7298810 | 0.77 | CA2 (0.65) | CA2HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL7295500 | 0.77 | CA2 (0.65) | CA2HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL3917294 | 0.74 | CA2 (0.67) | CA2HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL2229511 | 0.72 | CA2 (0.40) | CA2HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL28801429 | 0.71 | PSIP1 (0.45) | CA2PSIP1POLBSMN1; SMN2KDM4E | |
| 1,4-Butanediol SCHEMBL28575010 | 0.70 | TSHR (0.73) | CA2ESR2PSIP1POLBSMN1; SMN2 | |
| SCHEMBL12786232 | 0.69 | HSD11B1 (0.42) | ESR2PSIP1POLBSMN1; SMN2KDM4E | |
| Dodecanol SCHEMBL28143360 | 0.69 | SMN1; SMN2 (0.57) | PSIP1POLBSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL7207184 | 0.69 | CA2 (0.66) | CA2HDAC1HDAC2HDAC3HDAC4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4732914-A | Prostacyclin analogs | THE UPJOHN COMPANY (US) | 1988-03-22 | — | — | US | disclosed |
| US-4705806-A | Prostacyclin analogs | PHARMACIA & UPJOHN COMPANY | 1987-11-10 | — | — | US | disclosed |
| US-4238414-A | 2-Decarboxy-2-aminomethyl-6a-carba-PGI2 compounds | THE UPJOHN COMPANY (US) | 1980-12-09 | — | — | US | disclosed |