Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28766916 | 0.96 | TSHR (0.42) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL27910545 | 0.93 | CNR1 (0.46) | TSHRALDH1A1TDP1CNR1CNR2 | |
| SCHEMBL10644943 | 0.89 | TSHR (0.48) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL11278699 | 0.83 | CA2 (0.43) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL981802 | 0.81 | TSHR (0.48) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL1822446 | 0.80 | TSHR (0.52) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL12971476 | 0.79 | CYP1A2 (0.43) | ALDH1A1TDP1ESR1ESR2CNR1 | |
| SCHEMBL6547258 | 0.79 | TSHR (0.52) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL980190 | 0.79 | TSHR (0.52) | TSHRALDH1A1TDP1ESR1ESR2 | |
| SCHEMBL8617659 | 0.79 | TSHR (0.47) | TSHRALDH1A1TDP1ESR1ESR2 |
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-4124545-A | Carbamic acid esters as catalysts for trimerization of isocyanates | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-07 | — | — | US | disclosed |
| US-3985789-A | Carbamic acid esters | BAYER AKTIENGESELLSCHAFT (DT) | 1976-10-12 | — | — | US | disclosed |