Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NT5E | P21589 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 8/20 | 0.41 |
| ▸ | CA2 | P00918 | 8/20 | 0.41 |
| ▸ | CA12 | O43570 | 7/20 | 0.41 |
| ▸ | CA9 | Q16790 | 7/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | AGO2 | Q9UKV8 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10639126 | 0.84 | CA1 (0.44) | TSHRALDH1A1NT5ELMNACYP3A4 | |
| SCHEMBL30627934 | 0.76 | CES2 (0.48) | LMNACA1CA2CA12CA9 | |
| SCHEMBL587894 | 0.75 | ALDH1A1 (0.43) | TSHRALDH1A1LMNACYP3A4CYP2C9 | |
| SCHEMBL9790421 | 0.73 | GAA (0.50) | ALDH1A1LMNACA1CA2CA12 | |
| SCHEMBL9790445 | 0.73 | HSD17B10 (0.43) | TSHRALDH1A1CYP3A4CA1CA2 | |
| SCHEMBL725856 | 0.71 | MAPT (0.55) | TSHRALDH1A1LMNACYP3A4PARP10 | |
| SCHEMBL28031098 | 0.70 | TSHR (0.54) | TSHRALDH1A1NT5ELMNACYP3A4 | |
| Sulfuric Acid SCHEMBL28572498 | 0.70 | TSHR (0.68) | TSHRALDH1A1NT5ELMNACYP3A4 | |
| Sulfuric Acid SCHEMBL147074 | 0.70 | TSHR (0.68) | TSHRALDH1A1NT5ELMNACYP3A4 | |
| Sulfuric Acid SCHEMBL28270834 | 0.70 | TSHR (0.68) | TSHRALDH1A1NT5ELMNACYP3A4 |
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-4204056-A | Process and intermediates for preparing fiber-reactive phthalocyanine dyes | CASSELLA AKTIENGESELLSCHAFT (DE) | 1980-05-20 | — | — | US | disclosed |
| US-4191686-A | FROM SULFONYL HALIDE SUBSTITUTED PARENT BY AMIDATION WITH AROMATIC DIAMINE, DIAZOTIZING, COUPLING TO KETO SUCCINIC ESTER, CYCLIZING, COUPLING TO REACTIVE MOIETY | CASSELLA AKTIENGESELLSCHAFT (DE) | 1980-03-04 | — | — | US | disclosed |