Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8542469 | 0.90 | TSHR (0.49) | TSHRCYP3A4NISCHKDM4ENPBWR1 | |
| SCHEMBL5249670 | 0.83 | MAPT (0.56) | TSHRCYP3A4MAPTMEN1KMT2A | |
| SCHEMBL5528175 | 0.82 | S100A4 (0.46) | NISCHMAPTMEN1KMT2ARAB9A | |
| SCHEMBL8537593 | 0.82 | GSK3B (0.47) | TSHRNPBWR1MAPTMEN1KMT2A | |
| SCHEMBL8536034 | 0.82 | ESR1 (0.43) | KDM4EMAPTMEN1KMT2ARAB9A | |
| SCHEMBL8536432 | 0.81 | ALDH1A1 (0.48) | KDM4EMAPTRAB9ANPC1GAA | |
| SCHEMBL10680334 | 0.81 | MAPT (0.39) | TSHRCYP3A4NISCHKDM4EMAPT | |
| SCHEMBL1303527 | 0.80 | CSNK1A1 (0.50) | NISCHMAPTMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL1804372 | 0.79 | BRD4 (0.38) | TSHRCYP3A4NISCHKDM4ENPBWR1 | |
| SCHEMBL8536429 | 0.78 | VCAM1 (0.50) | MAPTMEN1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |