Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8132586 | 0.85 | LMNA (0.55) | ERN1ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL5722689 | 0.84 | LMNA (0.61) | ERN1ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL1390641 | 0.80 | ERN1 (0.46) | ERN1CHRM2CHRM1CHRNB2CHRM3 | |
| SCHEMBL10459592 | 0.78 | HTR2A (0.34) | ERN1ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL8121645 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KDM4ELMNAHPGDGAA | |
| SCHEMBL10366539 | 0.77 | L3MBTL1 (0.47) | ERN1ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL10366232 | 0.76 | ERN1 (0.48) | ERN1ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL10600748 | 0.75 | LMNA (0.58) | ERN1ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL13692691 | 0.75 | ERN1 (0.42) | ERN1ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL10460364 | 0.74 | CXCR3 (0.33) | CXCR3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0858444-A4 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0858444-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-08-19 | — | — | EP | disclosed |
| US-5750549-A | ANTIINFLAMMATORY AGENTS OR ANALGESICS | MERCK & CO., INC. (US) | 1998-05-12 | — | — | US | disclosed |
| WO-1997014671-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-04-24 | — | — | WO | disclosed |
| US-4966907-A | ANTIINFLAMMATORY AGENT, ANTIALLERGENS | MERCK & CO., INC. (US) | 1990-10-30 | — | — | US | disclosed |