Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.32 |
| ▸ | RELA | Q04206 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10406379 | 1.00 | NOS3 (0.33) | NOS3NOS2NFKB1NFKB2RELA | |
| SCHEMBL10406377 | 1.00 | NOS3 (0.33) | NOS3NOS2NFKB1NFKB2RELA | |
| SCHEMBL10406774 | 0.83 | — | — | |
| SCHEMBL10406776 | 0.83 | — | — | |
| SCHEMBL11058198 | 0.79 | NFKB1 (0.33) | NFKB1NFKB2RELA | |
| SCHEMBL15418719 | 0.77 | NFKB1 (0.38) | NFKB1NFKB2RELA | |
| SCHEMBL15480919 | 0.73 | — | — | |
| SCHEMBL11237892 | 0.71 | NFKB1 (0.33) | NFKB1NFKB2RELA | |
| SCHEMBL13766089 | 0.68 | — | — | |
| SCHEMBL11060621 | 0.67 | NOS3 (0.35) | NOS3NOS2L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4921994-A | ANALGESICS, ANTIEMETICS | PFIZER INC. (US) | 1990-05-01 | — | — | US | disclosed |
| US-4831059-A | ANTIEMETICS; DIARRHEA; CENTRAL NERVOUS SYSTEM | PFIZER INC. (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0048572-B1 | SUBSTITUTED 2-HYDROXYPHENYL CYCLOALKANES AND PHARMACEUTICAL COMPOSITIONS THEREOF | PFIZER INC. (US) | 1987-07-15 | — | — | EP | disclosed |
| US-4371720-A | ANTIDIARRHEALS, ANTIEMETICS | PFIZER INC. (US) | 1983-02-01 | — | — | US | disclosed |