Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 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 | |
|---|---|---|---|---|
| SCHEMBL3228663 | 0.80 | TSHR (0.40) | TSHRLMNA | |
| SCHEMBL320579 | 0.77 | — | — | |
| SCHEMBL27757358 | 0.77 | TSHR (0.35) | TSHRLMNA | |
| SCHEMBL599070 | 0.75 | TSHR (0.35) | TSHRALDH1A1MAPK1 | |
| SCHEMBL1614311 | 0.74 | LMNA (0.42) | TSHRLMNAALDH1A1MAPK1 | |
| SCHEMBL9788178 | 0.74 | ANPEP (0.42) | TSHRALDH1A1MAPK1ANPEP | |
| SCHEMBL17464917 | 0.74 | LMNA (0.42) | TSHRLMNAALDH1A1MAPK1 | |
| SCHEMBL11280505 | 0.74 | TSHR (0.35) | TSHR | |
| SCHEMBL11533508 | 0.73 | TSHR (0.33) | TSHRALDH1A1MAPK1 | |
| SCHEMBL12812805 | 0.72 | TSHR (0.33) | TSHRLMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1027315-B1 | PROCESS FOR THE PRODUCTION OF N-BUTANOL | CELANESE INT CORP (US) | 2003-06-04 | — | — | EP | disclosed |
| EP-1027315-A1 | PROCESS FOR THE PRODUCTION OF N-BUTANOL | Celanese International Corporation (US) | 2000-08-16 | — | — | EP | disclosed |
| US-5922921-A | CONTACTING N-BUTYRALDEHYDE AND HYDROGEN WITH ACTIVE POROUS COBALT CATALYST IN HYDROGENATION ZONE, PURIFYING BY FRACTIONAL DISTILLATION | CELANESE INTERNATIONAL CORPORATION (US) | 1999-07-13 | — | — | US | disclosed |
| WO-1999021812-A1 | PROCESS FOR THE PRODUCTION OF N-BUTANOL | CELANESE INTERNATIONAL CORPORATION (US) | 1999-05-06 | — | — | WO | disclosed |