Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.48 |
| ▸ | CASR | P41180 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL31229321 | 0.87 | FFAR1 (0.53) | LDHACASRNPC1RAB9AMMP2 | |
| Hydrochloric Acid SCHEMBL27792421 | 0.86 | FFAR1 (0.52) | LDHACASRNPC1RAB9AMMP2 | |
| SCHEMBL1097490 | 0.85 | LDHA (0.63) | LDHAPPARGNPC1RAB9AMMP2 | |
| SCHEMBL1177223 | 0.85 | PDCD1 (0.56) | LDHAPPARGNPC1RAB9AHDAC8 | |
| SCHEMBL1177224 | 0.85 | PDCD1 (0.56) | LDHAPPARGNPC1RAB9AHDAC8 | |
| SCHEMBL1177136 | 0.85 | PDCD1 (0.56) | LDHAPPARGNPC1RAB9AHDAC8 | |
| SCHEMBL29213287 | 0.85 | LDHA (0.48) | LDHAPPARGCASRNPC1RAB9A | |
| SCHEMBL2242522 | 0.85 | MMP2 (0.48) | LDHAPPARGCASRNPC1RAB9A | |
| SCHEMBL29213290 | 0.85 | LDHA (0.48) | LDHAPPARGCASRNPC1RAB9A | |
| SCHEMBL1760907 | 0.84 | LDHA (0.53) | LDHAPPARGNPC1RAB9AHDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993000359-A1 | MODIFIED PEPTIDES TRANSPORTABLE INTO THE CENTRAL NERVOUS SYSTEM | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-01-07 | — | — | WO | disclosed |