Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | MEN1 | O00255 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 2/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9370410 | 0.81 | NPC1 (0.47) | NPC1MEN1KMT2ARAB9AHTT | |
| SCHEMBL11536024 | 0.77 | NPC1 (0.57) | NPC1MEN1KMT2ARAB9AHTT | |
| SCHEMBL11474924 | 0.75 | CCNT1 (0.43) | NPC1MEN1KMT2ARAB9AHTT | |
| SCHEMBL9512470 | 0.75 | NPC1 (0.44) | NPC1MEN1KMT2ARAB9AHTT | |
| SCHEMBL9512816 | 0.75 | NPC1 (0.44) | NPC1MEN1KMT2ARAB9AHTT | |
| SCHEMBL11474917 | 0.73 | MAPT (0.39) | NPC1MEN1KMT2ARAB9AHTT | |
| Ammonia Solution, Strong SCHEMBL10556485 | 0.71 | ATM (0.66) | MAPTSMN1; SMN2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8621698 | 0.70 | ATM (0.63) | MAPTSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL427541 | 0.69 | ATM (0.68) | MAPTSMN1; SMN2KDM4EALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL10431156 | 0.68 | PGK1 (0.42) | MEN1KMT2ATP53PKMPGK1 |
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-0363964-B1 | Benzotriazole derivatives and chiral derivatization reagents for carboxylic acids thereof | SHIONOGI & CO (JP) | 1993-12-29 | — | — | EP | claimed |