Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 13/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7417469 | 0.91 | ERN1 (0.48) | ERN1LMNAMAPTPRKDC | |
| SCHEMBL15535074 | 0.82 | ERN1 (0.49) | ERN1LMNAMAPTPRKDCKDM4E | |
| SCHEMBL16978281 | 0.81 | ERN1 (0.51) | ERN1LMNAMAPTPRKDCKDM4E | |
| SCHEMBL7407211 | 0.81 | P2RX3 (0.41) | ERN1MAPTP2RX3KDM4EALDH1A1 | |
| SCHEMBL15547540 | 0.75 | ERN1 (0.62) | ERN1LMNAMAPTPRKDCKDM4E | |
| SCHEMBL21933489 | 0.74 | ERN1 (0.54) | ERN1LMNAMAPTALDH1A1 | |
| SCHEMBL14925248 | 0.74 | KDM4E (0.51) | ERN1LMNAMAPTKDM4EALDH1A1 | |
| SCHEMBL7414964 | 0.74 | MAPT (0.43) | ERN1LMNAMAPTPRKDCKDM4E | |
| SCHEMBL146097 | 0.73 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1 | |
| SCHEMBL9227782 | 0.72 | TLR2 (0.53) | ERN1LMNAMAPTKDM4E |
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-6150412-A | SUCH AS 4-(5-HYDROXY-4-METHOXY-2-NITROPHENYL)BUTANOIC ACID; ADMINISTERING TO INHIBIT CATECHOL-O-METHYL TRANSFERASE; TREATING PARKINSON'S DISEASE OR HYPERTENSION | ORION-YHTYMA OY (FI) | 2000-11-21 | — | — | US | disclosed |
| WO-1996037456-A1 | NEW CATECHOL DERIVATIVES | Orion-Yhtymä Oy (FI) | 1996-11-28 | — | — | WO | disclosed |