Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.49 |
| ▸ | ALPI | P09923 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | XIAP | P98170 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2951695 | 0.97 | ALDH1A1 (0.59) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5009929 | 0.96 | ALDH1A1 (0.62) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8060168 | 0.88 | ITGB1 (0.57) | ALDH1A1POLBSLC7A5PTPN1ITGB3 | |
| SCHEMBL8058266 | 0.88 | PTPN1 (0.47) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21689918 | 0.88 | KMT2A (0.58) | ALDH1A1MEN1KMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL2857963 | 0.88 | ITGB1 (0.57) | ALDH1A1POLBSLC7A5PTPN1ITGB3 | |
| SCHEMBL8058263 | 0.88 | PTPN1 (0.47) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21690440 | 0.88 | KMT2A (0.58) | ALDH1A1MEN1KMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL17822347 | 0.83 | ALDH1A1 (0.55) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL17822346 | 0.83 | ALDH1A1 (0.55) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2007392-A2 | METHODS OF TREATING INFLAMMATORY AND AUTOIMMUNE DISEASES WITH ALPHA-4 INHIBITORY COMPOUNDS | ELAN PHARMACEUTICALS, INC. (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007100763-A2 | METHODS OF TREATING INFLAMMATORY AND AUTOIMMUNE DISEASES WITH ALPHA-4 INHIBITORY COMPOUNDS | ELAN PHARMACEUTICALS, INC. (US) | 2007-09-07 | — | — | WO | disclosed |