Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4697569 | 0.80 | ALDH1A1 (0.52) | HTR7ALDH1A1KDM4EMAPTIMPDH2 | |
| SCHEMBL9445884 | 0.79 | NOTUM (0.44) | TSHRHTR7KMT2AMAPTHTR3A | |
| SCHEMBL15565198 | 0.75 | HTR7 (0.40) | HTR7ALDH1A1KMT2AKDM4EMAPT | |
| SCHEMBL9428481 | 0.72 | TSHR (0.46) | TSHRHTR7ALDH1A1KMT2ACYP1A2 | |
| SCHEMBL13964662 | 0.72 | IMPDH2 (0.46) | TSHRHTR7ALDH1A1KMT2AMAPT | |
| SCHEMBL1093309 | 0.70 | ALDH1A1 (0.56) | TSHRALDH1A1KMT2AKDM4EMAPT | |
| SCHEMBL9429932 | 0.69 | TSHR (0.44) | TSHRALDH1A1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL20115834 | 0.67 | TSHR (0.48) | TSHRHTR7ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL2314684 | 0.66 | ALDH1A1 (0.42) | TSHRALDH1A1KMT2APTGDR2MAPT | |
| SCHEMBL24552907 | 0.66 | ALDH1A1 (0.59) | ALDH1A1KMT2ACYP1A2CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0547827-A1 | Indole and benzimidazole-substituted dihydropyrimidine derivatives useful as A-II receptors antagonists | E.R. SQUIBB & SONS, INC. (US) | 1993-06-23 | — | — | EP | disclosed |
| US-5212177-A | INDOLE AND BENZIMIDAZOLE-SUBSTITUTED DIHYDROPYRIMIDINE DERIVATIVES | E. R. SQUIBB & SONS, INC. (US) | 1993-05-18 | — | — | US | disclosed |