Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | TDP2 | O95551 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9672587 | 0.79 | ALDH1A1 (0.49) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL18759751 | 0.77 | THRB (0.50) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL406841 | 0.76 | THRB (0.65) | THRBTDP1APEX1PDK2ALDH1A1 | |
| SCHEMBL30888607 | 0.70 | THRB (0.47) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL9938667 | 0.70 | THRB (0.47) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL8737319 | 0.69 | S100A4 (0.48) | THRBTDP1S100A4PDK2MAPT | |
| SCHEMBL13668289 | 0.69 | PDK2 (0.40) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL10915746 | 0.69 | PDK2 (0.51) | THRBTDP1S100A4APEX1PDK2 | |
| SCHEMBL24355593 | 0.68 | THRB (0.45) | THRBTDP1APEX1PDK2ALDH1A1 | |
| SCHEMBL29612259 | 0.68 | S100A4 (0.65) | THRBTDP1S100A4APEX1PDK2 |
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-9682060-B2 | Small molecules that induce intrinsic pathway apoptosis | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-06-20 | — | — | US | disclosed |
| US-9682060-B2 | Small molecules that induce intrinsic pathway apoptosis | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-06-20 | — | — | US | disclosed |
| US-20170105963-A1 | SMALL MOLECULES THAT INDUCE INTRINSIC PATHWAYS APOPTOSIS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-04-20 | — | — | US | disclosed |
| US-20170105963-A1 | SMALL MOLECULES THAT INDUCE INTRINSIC PATHWAYS APOPTOSIS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-04-20 | — | — | US | 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 (1 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-20170105963-A1 | SMALL MOLECULES THAT INDUCE INTRINSIC PATHWAYS APOPTOSIS | AIFM1, VDAC1, AFG3L2 | THRB 3138/4885TDP1 4180/4885S100A4 2790/4885 |
“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.