Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.55 |
| ▸ | NPC1 | O15118 | 8/20 | 0.55 |
| ▸ | HTT | P42858 | 6/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 9/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.52 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL230641 | 0.81 | ALDH1A1 (0.70) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL230069 | 0.80 | NPC1 (0.56) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL231419 | 0.76 | KDM4E (0.64) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL4017475 | 0.74 | ALDH1A1 (0.62) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL5009162 | 0.74 | KDM4E (0.77) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL25445606 | 0.73 | KDM4E (0.55) | ALDH1A1KDM4EHTTSMN1; SMN2GAA | |
| SCHEMBL4782915 | 0.73 | NPY5R (0.77) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL1104819 | 0.72 | TNF (0.66) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL19275978 | 0.72 | KDM4E (0.77) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 | |
| SCHEMBL11727105 | 0.71 | MMP2 (0.48) | ALDH1A1KDM4ENPC1HTTSMN1; SMN2 |
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-1117651-A1 | NEW BIS-BENZIMIDAZOLES | Bayer Aktiengesellschaft (DE) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000020401-A1 | NEW BIS-BENZIMIDAZOLES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-04-13 | — | — | WO | disclosed |