Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL334596 | 0.99 | TDP1 (0.44) | TDP1KMT2AMMP1MMP2MMP9 | |
| Hydrochloric Acid SCHEMBL334598 | 0.99 | TDP1 (0.44) | TDP1KMT2AMMP1MMP2MMP9 | |
| Hydrochloric Acid SCHEMBL334595 | 0.99 | TDP1 (0.44) | TDP1KMT2AMMP1MMP2MMP9 | |
| Hydrochloric Acid SCHEMBL334597 | 0.99 | TDP1 (0.44) | TDP1KMT2AMMP1MMP2MMP9 | |
| SCHEMBL4564486 | 0.82 | NPY4R (0.51) | KMT2A | |
| SCHEMBL334437 | 0.81 | KMT2A (0.49) | TDP1KMT2AMMP1MMP2MMP9 | |
| N-Isobutylcinnamamide SCHEMBL11965211 | 0.80 | KMT2A (0.63) | TDP1KMT2AMMP1MMP2MMP9 | |
| SCHEMBL335154 | 0.80 | KMT2A (0.45) | TDP1KMT2AMMP1MMP2MMP9 | |
| SCHEMBL334003 | 0.79 | HDAC3 (0.48) | BACE1CASP1CASP3CASP7CASP6 | |
| SCHEMBL334004 | 0.79 | HDAC3 (0.48) | BACE1CASP1CASP3CASP7CASP6 |
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-8097582-B2 | Peptide derivatives useful as antimicrobial agents and for treating wounds | NEOBIOTICS AB (SE) | 2012-01-17 | — | — | US | disclosed |