Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMOX1 | P09601 | 1/20 | 0.61 |
| ▸ | NOS1 | P29475 | 2/20 | 0.58 |
| ▸ | SOD1 | P00441 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.53 |
| ▸ | QPCT | Q16769 | 3/20 | 0.52 |
| ▸ | PIM1 | P11309 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11495035 | 0.86 | SOD1 (0.67) | SOD1CYP19A1QPCTNPC1RAB9A | |
| SCHEMBL2539814 | 0.84 | SOD1 (0.57) | SOD1CYP19A1CYP11B1CYP11B2QPCT | |
| Hydrochloric Acid SCHEMBL5191266 | 0.83 | SOD1 (0.56) | SOD1CYP19A1CYP11B1CYP11B2QPCT | |
| SCHEMBL8443968 | 0.81 | HMOX1 (0.65) | HMOX1NOS1MAPK1CYP19A1CYP11B1 | |
| SCHEMBL10833094 | 0.79 | CYP1A2 (0.77) | QPCTNPC1LMNAALDH1A1GAA | |
| SCHEMBL5189230 | 0.79 | QPCT (0.69) | SOD1CYP19A1QPCTNPC1RAB9A | |
| SCHEMBL11404089 | 0.78 | HMOX1 (0.91) | HMOX1NOS1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8443891 | 0.77 | HMOX1 (0.53) | HMOX1NOS1MAPK1CYP19A1CYP11B1 | |
| SCHEMBL4770380 | 0.77 | SMN1; SMN2 (0.78) | CYP19A1NPC1LMNAALDH1A1GAA | |
| SCHEMBL291484 | 0.77 | QPCT (0.54) | SOD1CYP19A1QPCTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1037511-C | Therapeutic agents | BOOTS CO PLC (GB) | 1998-02-25 | — | — | CN | disclosed |
| CN-1096781-A | The therapeutical agent that contains 1-(aralkyl-aminoalkyl) imidazolium compounds | BOOTS CO PLC (GB) | 1994-12-28 | — | — | CN | disclosed |