Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 6/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11722636 | 0.86 | ALDH1A1 (0.51) | MMP2MMP9MMP8MMP13NPC1 | |
| SCHEMBL11725236 | 0.84 | MMP2 (0.51) | MMP2MMP9MMP8MMP13NPC1 | |
| SCHEMBL11720143 | 0.82 | GLA (0.47) | NPC1SMN1; SMN2ALDH1A1RAB9AMAPT | |
| SCHEMBL4277260 | 0.75 | ACHE (0.55) | MMP2MMP9MMP8KDRACHE | |
| SCHEMBL9233969 | 0.72 | BRD2 (0.52) | NPC1SMN1; SMN2ALDH1A1HTTRAB9A | |
| SCHEMBL7485661 | 0.71 | ALDH1A1 (0.55) | NPC1SMN1; SMN2ALDH1A1HTTKDM4E | |
| SCHEMBL11725726 | 0.70 | MMP2 (0.45) | MMP2MMP9MMP8MMP13NPC1 | |
| SCHEMBL11725733 | 0.70 | MMP2 (0.57) | MMP2MMP9MMP8MMP13NPC1 | |
| SCHEMBL11721710 | 0.70 | POLB (0.44) | NPC1SMN1; SMN2ALDH1A1HTTKDM4E | |
| SCHEMBL11722858 | 0.69 | NPBWR1 (0.59) | MMP2MMP9MMP8MMP13NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4053472-A | MICROBIOCIDES | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-10-11 | — | — | US | disclosed |