Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | CTSC | P53634 | 1/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8258150 | 1.00 | CYP2C19 (0.49) | CYP2C19RAB9AALDH1A1PKMTSHR | |
| SCHEMBL5870011 | 0.85 | CYP2C19 (0.55) | CYP2C19RAB9AALDH1A1PKMTSHR | |
| SCHEMBL8248802 | 0.85 | CYP2C19 (0.55) | CYP2C19RAB9AALDH1A1PKMTSHR | |
| SCHEMBL5870042 | 0.78 | MME (0.44) | CTSK | |
| SCHEMBL5870172 | 0.78 | POLB (0.42) | RAB9AALDH1A1POLBKMT2ATDP1 | |
| SCHEMBL8254423 | 0.78 | POLB (0.42) | RAB9AALDH1A1POLBKMT2ATDP1 | |
| SCHEMBL8249013 | 0.78 | MME (0.44) | CTSK | |
| SCHEMBL5092768 | 0.76 | PKM (0.63) | RAB9AALDH1A1PKMLMNAPOLB | |
| SCHEMBL5092771 | 0.76 | PKM (0.63) | RAB9AALDH1A1PKMLMNAPOLB | |
| SCHEMBL22092589 | 0.76 | CYP2C19 (0.56) | CYP2C19RAB9AALDH1A1PKMCTSC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7045532-B2 | ACE-2 modulating compounds and methods of use thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2006-05-16 | — | — | US | disclosed |
| US-6632830-B1 | Blood pressure related disease or disorder, cell proliferation disorder, kidney disorder, kinetensin associated disorder, inflammation associated disorder, or an allergic disorder | MILLENNIUM PHARMACEUTICALS, INC. | 2003-10-14 | — | — | US | disclosed |