Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 16/20 | 0.50 |
| ▸ | FAAH | O00519 | 6/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.42 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18499740 | 0.86 | MGLL (0.56) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL18626072 | 0.85 | MGLL (0.54) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL21727076 | 0.81 | MGLL (0.56) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL18888720 | 0.81 | MGLL (0.48) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL18752311 | 0.78 | MGLL (0.46) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL8985186 | 0.78 | MGLL (0.58) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL18888719 | 0.75 | MGLL (0.51) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL3185260 | 0.75 | MGLL (0.65) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL9588255 | 0.75 | MGLL (0.65) | MGLLFAAHHSP90AA1TDP1NPSR1 | |
| SCHEMBL2412811 | 0.75 | MGLL (0.65) | MGLLFAAHHSP90AA1TDP1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3309162-A1 | TARGETED CONJUGATES OF PYRROLOBENZODIAZEPINES | Seattle Genetics, Inc. (US) | 2018-04-18 | — | — | EP | disclosed |