Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11862459 | 0.71 | ADORA2A (0.50) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL2320673 | 0.70 | SMN1; SMN2 (0.57) | ADORA1LMNAKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL13108726 | 0.70 | NPSR1 (0.59) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL10845179 | 0.69 | SMN1; SMN2 (0.36) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL10845664 | 0.69 | ADORA1 (0.37) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL11864615 | 0.68 | ADORA2A (0.47) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL10811365 | 0.68 | ADORA2A (0.47) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL10810257 | 0.68 | RAB9A (0.43) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL10812119 | 0.68 | NPSR1 (0.68) | ADORA2AADORA1LMNAGAAKDM4E | |
| SCHEMBL11338853 | 0.68 | ADORA1 (0.47) | ADORA2AADORA1LMNAGAAKDM4E |
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-4157392-A | HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS AND NERVOUS SYSTEM EFFECTS | DIAMOND SHAMROCK CORPORATION (US) | 1979-06-05 | — | — | US | claimed |