Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KLK1 | P06870 | 1/20 | 0.45 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7290997 | 0.89 | PKM (0.49) | PKMSMN1; SMN2ALDH1A1MAPTKDM4E | |
| Hydrochloric Acid SCHEMBL7300661 | 0.88 | PKM (0.51) | PKMSMN1; SMN2ALDH1A1MAPTKDM4E | |
| SCHEMBL7340177 | 0.76 | MPO (0.48) | SMN1; SMN2ALDH1A1MAPTKDM4EHSD17B10 | |
| SCHEMBL21274517 | 0.74 | PIN1 (0.57) | SMN1; SMN2ALDH1A1MAPTKDM4EHSD17B10 | |
| SCHEMBL21274521 | 0.74 | PIN1 (0.57) | SMN1; SMN2ALDH1A1MAPTKDM4EHSD17B10 | |
| SCHEMBL9006062 | 0.74 | KMT2A (0.43) | KMT2A | |
| SCHEMBL2639241 | 0.74 | KMT2A (0.43) | KMT2A | |
| SCHEMBL2639238 | 0.74 | KMT2A (0.43) | KMT2A | |
| SCHEMBL3915446 | 0.73 | POLB (0.63) | PKMSMN1; SMN2ALDH1A1MAPTKDM4E | |
| SCHEMBL9007614 | 0.73 | CTSS (0.50) | SMN1; SMN2ALDH1A1MAPTKDM4ERAB9A |
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-0480714-A2 | HIV protease inhibitors having symmetrical structure | MERCK & CO. INC. (US) | 1992-04-15 | — | — | EP | disclosed |