Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 1/20 | 0.47 |
| ▸ | PLG | P00747 | 1/20 | 0.45 |
| ▸ | Q9HBH1 | 1/20 | 0.45 | |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.43 |
| ▸ | NMT2 | O60551 | 1/20 | 0.42 |
| ▸ | NMT1 | P30419 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | MMP3 | P08254 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18738463 | 0.96 | SMN1; SMN2 (0.45) | KLKB1PLGPDFNPC1RAB9A | |
| SCHEMBL23189264 | 0.85 | ITGB3 (0.42) | NPC1RAB9ASMN1; SMN2PTPN1HPGD | |
| SCHEMBL19681568 | 0.85 | ITGB3 (0.42) | NPC1RAB9ASMN1; SMN2PTPN1HPGD | |
| SCHEMBL24864663 | 0.85 | KLKB1 (0.48) | KLKB1PLGPDFCALCRLNMT2 | |
| SCHEMBL24864484 | 0.84 | KLKB1 (0.47) | KLKB1PLGPDFCALCRLCA1 | |
| SCHEMBL23425577 | 0.81 | KLKB1 (0.45) | KLKB1PLGPDFCALCRLCA1 | |
| SCHEMBL14966039 | 0.80 | SMN1; SMN2 (0.45) | KLKB1PLGPDFSMN1; SMN2CALCRL | |
| SCHEMBL29335395 | 0.80 | KLKB1 (0.43) | KLKB1PLGPDFCALCRLMMP3 | |
| SCHEMBL15686242 | 0.79 | NMT2 (0.45) | KLKB1PLGPDFCALCRLNMT2 | |
| SCHEMBL16418621 | 0.79 | KLKB1 (0.49) | KLKB1PLGPDFCALCRLCA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1747021-B1 | SELF-IMMOLATIVE LINKERS AND DRUG CONJUGATES | SQUIBB & SONS LLC (US) | 2015-09-09 | — | — | EP | disclosed |