Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1899771 | 0.85 | PARP1 (0.43) | PARP1GAABCL2L1HCAR2HTR2C | |
| Water SCHEMBL8182334 | 0.83 | PARP1 (0.42) | PARP1GAABCL2L1HCAR2HTR2C | |
| SCHEMBL305311 | 0.69 | PARP1 (0.42) | PARP1GAAHTR2CALDH1A1LMNA | |
| SCHEMBL5600491 | 0.69 | HTR2C (0.45) | PARP1TSHRGAAHTR2CALDH1A1 | |
| SCHEMBL17296040 | 0.68 | PARP1 (0.43) | PARP1BCL2L1ALDH1A1HSD17B10HPGD | |
| SCHEMBL1203617 | 0.67 | LTB4R (0.50) | PARP1TSHRGAAHTR2CALDH1A1 | |
| SCHEMBL30471604 | 0.66 | IDH1 (0.59) | ALOX5PKMBCL2L1OPRK1DRD2 | |
| SCHEMBL1531575 | 0.66 | IDH1 (0.59) | ALOX5PKMBCL2L1OPRK1DRD2 | |
| SCHEMBL9525223 | 0.65 | LTB4R (0.49) | PARP1GAAHTR2CALDH1A1LMNA | |
| SCHEMBL21531465 | 0.65 | CALM1 (0.46) | PARP1GAAHTR2CALDH1A1LMNA |
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-1988002754-A1 | NEW PEPTIDES AND APPLICATIONS THEREOF | TRION FORSKNING- OCH UTVECKLINGS AKTIEBOLAG (SE) | 1988-04-21 | — | — | WO | disclosed |