Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16136708 | 0.77 | MME (0.43) | NPC1RAB9ASLC6A2MMP12MMP13 | |
| SCHEMBL2019334 | 0.72 | HSD17B10 (0.33) | MAPTPOLBMEN1KMT2A | |
| SCHEMBL10098 | 0.72 | BLM (0.39) | CPA1SLC7A5SLC6A2MMP12MMP13 | |
| SCHEMBL2016292 | 0.72 | ALPI (0.41) | ALDH1A1MAPTCYP1A2POLBNPC1 | |
| SCHEMBL28705762 | 0.66 | EPHX1 (0.49) | MAPTCYP1A2POLBNPC1RAB9A | |
| SCHEMBL12458539 | 0.66 | TRPA1 (0.47) | CYP1A2NPC1RAB9AALPIPKM | |
| SCHEMBL27665298 | 0.66 | SMN1; SMN2 (0.44) | CYP1A2POLBNPC1RAB9AALPI | |
| SCHEMBL13108162 | 0.66 | CYP1A2 (0.47) | ALDH1A1CYP1A2NPC1RAB9AALPI | |
| SCHEMBL11706061 | 0.65 | TAAR1 (0.50) | CYP1A2SLC6A2 | |
| SCHEMBL8961746 | 0.65 | CYP1A2 (0.46) | MAPTCYP1A2CPA1POLBNPC1 |
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-2011073845-A1 | N-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS | PFIZER INC. (US) | 2011-06-23 | — | — | WO | disclosed |