Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.54 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.53 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.52 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.52 |
| ▸ | ALPI | P09923 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | XIAP | P98170 | 1/20 | 0.50 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.50 |
| ▸ | AGXT | P21549 | 1/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7888402 | 1.00 | PIN1 (0.54) | PIN1LOXL2PSMB8PSMB5ALPI | |
| Hydrochloric Acid SCHEMBL8578217 | 0.98 | PIN1 (0.53) | PIN1LOXL2PSMB8PSMB5ALPI | |
| SCHEMBL1176465 | 0.85 | LOXL2 (0.50) | PIN1LOXL2PSMB8PSMB5PKM | |
| SCHEMBL7886152 | 0.81 | MAOB (0.48) | PIN1LOXL2PSMB8PSMB5AGXT | |
| SCHEMBL5281333 | 0.81 | MMP2 (0.52) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL27134734 | 0.79 | SLC1A5 (0.46) | LOXL2ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL26987879 | 0.79 | SLC1A5 (0.46) | LOXL2ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL3162620 | 0.77 | MMP12 (0.58) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL2022678 | 0.77 | LOXL2 (0.59) | PIN1LOXL2PSMB8PSMB5AGXT | |
| SCHEMBL6955352 | 0.76 | LOXL2 (0.62) | PIN1LOXL2PSMB8PSMB5AGXT |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008068621-A2 | COMBINATION PRODUCT WITH IDO INHIBITOR AND TUMOR TARGETED IFN-GAMMA | MOLMED SPA (IT) | 2008-06-12 | — | — | WO | disclosed |
| EP-0799221-B1 | QUINAZOLINES AS INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER LAMBERT CO (US) | 2002-10-30 | — | — | EP | disclosed |
| US-5414013-A | Enzyme inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1995-05-09 | — | — | US | disclosed |
| US-5414017-A | Cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1995-05-09 | — | — | US | disclosed |
| WO-1994028012-A1 | HYDROXAMATE INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER-LAMBERT COMPANY (US) | 1994-12-08 | — | — | WO | disclosed |
| EP-0449523-B1 | Mercapto- or acylthio-trifluoromethyl amide derivatives and their use | SQUIBB & SONS INC (US) | 1994-08-17 | — | — | EP | disclosed |
| US-5223516-A | Endopeptidase inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1993-06-29 | — | — | US | disclosed |
| EP-0449523-A1 | Mercapto- or acylthio-trifluoromethyl amide derivatives and their use | E.R. SQUIBB & SONS, INC. (US) | 1991-10-02 | — | — | EP | disclosed |