Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10915437 | 0.85 | F2 (0.44) | KMT2ASMN1; SMN2PLAUMEN1NLRP3 | |
| SCHEMBL7342025 | 0.75 | KMT2A (0.62) | KMT2AESR1MAPTPLAUMEN1 | |
| SCHEMBL10922460 | 0.71 | PLAU (0.54) | MAPTPLAU | |
| SCHEMBL27503308 | 0.71 | PARP1 (0.55) | KMT2AESR1SMN1; SMN2RAB9ACA1 | |
| SCHEMBL779390 | 0.70 | PARP1 (0.53) | KMT2AESR1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL27937494 | 0.69 | PARP1 (0.52) | KMT2AESR1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL777192 | 0.69 | TDP1 (0.46) | KMT2AESR1RAB9AELANEPARP1 | |
| SCHEMBL27221107 | 0.68 | ALDH1A1 (0.43) | SMN1; SMN2CA1CA2ELANEPOLB | |
| SCHEMBL27808160 | 0.68 | PARP1 (0.50) | KMT2AESR1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL778589 | 0.67 | PARP1 (0.49) | KMT2AESR1SMN1; SMN2RAB9AELANE |
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 |
|---|---|---|---|---|---|---|---|
| US-4454338-A | 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE | TORII & CO., LTD. (JP) | 1984-06-12 | — | — | US | disclosed |