Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7206518 | 1.00 | ITGA4 (0.42) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3855374 | 0.85 | L3MBTL1 (0.45) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3855371 | 0.85 | L3MBTL1 (0.45) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3858901 | 0.85 | ITGA4 (0.44) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3858906 | 0.85 | ITGA4 (0.44) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3864783 | 0.84 | ITGA4 (0.51) | ITGA4ITGB7ATML3MBTL1ALDH1A1 | |
| SCHEMBL3862081 | 0.84 | ITGA4 (0.51) | ITGA4ITGB7ATML3MBTL1ALDH1A1 | |
| SCHEMBL7205432 | 0.83 | ITGA4 (0.38) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL7205429 | 0.83 | ITGA4 (0.38) | ITGA4ITGB7ATML3MBTL1POLB | |
| SCHEMBL3864432 | 0.80 | ITGA4 (0.42) | ITGA4ITGB7ATML3MBTL1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6613937-B2 | In particular for transdermal, oral, rectal and inhalational application | TSIKAS DIMITRIOS (DE) | 2003-09-02 | — | — | US | disclosed |
| US-20020091102-A1 | S-nitroso- and S-nitro-N-acyl-L-cysteine ester derivatives as pharmalogically active agents and pharmaceutical compositions containing said compounds | TSIKAS DIMITRIOS (DE) | 2002-07-11 | — | — | 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-20020091102-A1 | S-nitroso- and S-nitro-N-acyl-L-cysteine ester derivatives as pharmalogically active agents and pharmaceutical compositions containing said compounds | NNMT, NNT, CBS | ITGA4 3673/4885ITGB7 3668/4885ATM 3372/4885 |
“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.