Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 17/20 | 1.00 |
| ▸ | NFKB2 | Q00653 | 17/20 | 1.00 |
| ▸ | RELA | Q04206 | 17/20 | 1.00 |
| ▸ | CLPX | O76031 | 1/20 | 0.85 |
| ▸ | VCP | P55072 | 1/20 | 0.85 |
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | POLB | P06746 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | HTT | P42858 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | GLS | O94925 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12309144 | 0.93 | NFKB1 (0.89) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL12309165 | 0.93 | NFKB1 (1.00) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL18944112 | 0.92 | NFKB1 (0.85) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL11950378 | 0.92 | NFKB1 (0.85) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL12309143 | 0.92 | NFKB1 (1.00) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL12309166 | 0.92 | NFKB1 (1.00) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL26519341 | 0.92 | NFKB1 (1.00) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL11950396 | 0.91 | NFKB1 (0.84) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL18943972 | 0.91 | NFKB1 (0.84) | NFKB1NFKB2RELACLPXVCP | |
| SCHEMBL12309169 | 0.91 | NFKB1 (0.83) | NFKB1NFKB2RELACLPXVCP |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170066797-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2017-03-09 | — | — | US | disclosed |
| US-20170066797-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2017-03-09 | — | — | US | disclosed |
| US-20110230551-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH | 2011-09-22 | — | — | US | disclosed |
| US-20110230551-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH | 2011-09-22 | — | — | US | disclosed |
| WO-2010030395-A2 | WITHAFERIN A ANALOGS AND USES THEREOF | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2010-03-18 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20170066797-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | CYP51A1, HASPIN, NFATC1 | NFKB1 676/4885NFKB2 754/4885RELA 4064/4885 |
| US-20110230551-A1 | WITHAFERIN A ANALOGS AND USES THEREOF | CYP51A1, HASPIN, NFATC1 | NFKB1 676/4885NFKB2 754/4885RELA 4064/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.