Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA4 | P22748 | 5/20 | 0.42 |
| ▸ | CA6 | P23280 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL10813313 | 0.92 | CA1 (0.41) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL9513383 | 0.80 | NPC1 (0.39) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL728940 | 0.79 | CA1 (0.46) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL2730971 | 0.73 | NPC1 (0.44) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL420230 | 0.72 | NPC1 (0.51) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL12870052 | 0.72 | NPC1 (0.51) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL11669057 | 0.72 | KDM4E (0.50) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL11058566 | 0.72 | KDM4E (0.50) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL5918112 | 0.71 | CA1 (0.48) | CA1CA2CA4CA6NPC1 | |
| SCHEMBL3437946 | 0.71 | CA1 (0.49) | CA1CA2CA4CA6NPC1 |
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-4522949-A | 7-Oxabicycloheptane substituted prostaglandin interphenylene analogs useful as cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1985-06-11 | — | — | US | disclosed |