Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 1/20 | 0.50 |
| ▸ | ACR | P10323 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.46 |
| ▸ | RELA | Q04206 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10549983 | 0.98 | PRSS1 (0.48) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10551185 | 0.97 | LMNA (0.49) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10550390 | 0.96 | KMT2A (0.49) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10552899 | 0.95 | LMNA (0.47) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10551354 | 0.95 | PRSS1 (0.44) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10550392 | 0.92 | KMT2A (0.43) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10553127 | 0.92 | MAPT (0.43) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10549689 | 0.92 | KMT2A (0.44) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10555879 | 0.90 | MGLL (0.42) | PRSS1ACRKMT2AMAPTLMNA | |
| SCHEMBL10551829 | 0.90 | PRSS1 (0.41) | PRSS1ACRKMT2AMAPTLMNA |
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-4846998-A | LIQUID CRYSTALS, ESTERS, NITRILES; ETHERS, HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-07-11 | — | — | US | disclosed |