Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.37 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL15194218 | 0.97 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| SCHEMBL234076 | 0.97 | ALDH1A1 (0.41) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| Hydrochloric Acid SCHEMBL15194272 | 0.95 | ALDH1A1 (0.40) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| Hydrochloric Acid SCHEMBL15194419 | 0.95 | ALDH1A1 (0.40) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| SCHEMBL5332707 | 0.92 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| SCHEMBL14858388 | 0.90 | ALDH1A1 (0.40) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| SCHEMBL14061763 | 0.90 | KDM1A (0.35) | ALDH1A1TP53TSHRHSD11B1HSD11B2 | |
| SCHEMBL5323192 | 0.89 | — | — | |
| SCHEMBL25435115 | 0.87 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRHTTFFAR3 | |
| SCHEMBL5569331 | 0.83 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013120921-A9 | NOVEL PYRROLIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2015-10-08 | — | — | WO | disclosed |
| EP-2814822-A1 | NOVEL PYRROLIDINE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2014-12-24 | — | — | EP | disclosed |
| WO-2013120921-A1 | NOVEL PYRROLIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2013-08-22 | — | — | WO | disclosed |
| EP-1170281-B1 | 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof | SERVIER LAB (FR) | 2005-12-21 | — | — | EP | disclosed |
| EP-1170281-A1 | 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof | LES LABORATOIRES SERVIER (FR) | 2002-01-09 | — | — | EP | disclosed |