Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL323547 | 0.75 | XDH (0.54) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL2059464 | 0.74 | CDC7 (0.35) | SRD5A1XDHMEN1MAPTKMT2A | |
| Hydrogen Sulfide SCHEMBL6721312 | 0.73 | XDH (0.52) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL28287534 | 0.72 | SRC (0.33) | MEN1MAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL69556 | 0.72 | GABRA1 (0.48) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL6398012 | 0.70 | SRD5A1 (0.49) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL6013229 | 0.70 | GABRA1 (0.52) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL1413853 | 0.70 | SRD5A1 (0.49) | SRD5A1XDHMEN1MAPTKMT2A | |
| SCHEMBL5583739 | 0.68 | ERN1 (0.51) | SRD5A1MEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL4564372 | 0.68 | XDH (0.33) | XDHMEN1MAPTKMT2AGABRA1 |
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-7745454-B2 | Alpha amino acid derivatives-inhibitors of leukocyte adhesion mediated by VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 2010-06-29 | — | — | US | disclosed |
| US-20050085459-A1 | Alpha amino acid derivatives-inhibitors of leukocyte adhesion mediated by VLA-4 | KONRADI ANDREI W (US) | 2005-04-21 | — | — | 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-20050085459-A1 | Alpha amino acid derivatives-inhibitors of leukocyte adhesion mediated by VLA-4 | VCAM1, ICAM1, CD4 | SRD5A1 2701/4885XDH 2748/4885MEN1 1381/4885 |
“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.