Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TMPRSS4 | Q9NRS4 | 2/20 | 0.37 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.35 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8340423 | 0.99 | MAPT (0.40) | MAPTGPR35CYP1A2CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8116539 | 0.85 | CYP2C19 (0.40) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8428550 | 0.84 | GPR35 (0.38) | GPR35TMPRSS4P2RX1MEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8333007 | 0.83 | GPR35 (0.37) | GPR35TMPRSS4P2RX1MEN1ALDH1A1 | |
| SCHEMBL8116932 | 0.82 | MAPT (0.47) | MAPTSCN8ASCN10ACFTRKDM4E | |
| SCHEMBL8428562 | 0.81 | GPR35 (0.35) | GPR35TMPRSS4P2RX1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8102752 | 0.81 | MAPT (0.46) | MAPTSCN8ASCN10ACFTRPPARA | |
| SCHEMBL8430498 | 0.80 | GPR35 (0.36) | GPR35TMPRSS4P2RX1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8336174 | 0.80 | GPR35 (0.35) | GPR35TMPRSS4P2RX1MEN1KMT2A | |
| SCHEMBL8428603 | 0.80 | GPR35 (0.37) | GPR35TMPRSS4P2RX1 |
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-0791577-B1 | Ortho-substituted benzylguanidines, process for their preparation and their use as medicament or diagnostic agent as well as medicament containing them | HOECHST AG (DE) | 1999-11-03 | — | — | EP | claimed |