Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.63 |
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | HTR1D | P28221 | 1/20 | 0.51 |
| ▸ | HTR1B | P28222 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL23469156 | 0.86 | ESR1 (0.63) | POLBESR1CYP19A1ESR2TAAR1 | |
| SCHEMBL3318610 | 0.85 | TAAR1 (0.65) | TAAR1ADRA1AHTR2AMEN1KMT2A | |
| SCHEMBL639120 | 0.85 | POLB (0.57) | POLBESR1CYP19A1ESR2MEN1 | |
| SCHEMBL29828865 | 0.85 | TAAR1 (0.65) | TAAR1ADRA1AHTR2AMEN1KMT2A | |
| SCHEMBL27297772 | 0.83 | POLB (0.65) | POLBESR1CYP19A1ESR2 | |
| Hydrochloric Acid SCHEMBL30639583 | 0.83 | TAAR1 (0.62) | TAAR1ADRA1AHTR2AMEN1KMT2A | |
| SCHEMBL13690496 | 0.83 | POLB (0.65) | POLBESR1CYP19A1ESR2MEN1 | |
| Hydrochloric Acid SCHEMBL1437152 | 0.83 | TAAR1 (0.62) | TAAR1ADRA1AHTR2AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28472802 | 0.83 | POLB (0.56) | POLBESR1CYP19A1ESR2MEN1 | |
| SCHEMBL28051356 | 0.81 | POLB (0.63) | POLBESR1CYP19A1ESR2 |
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-5721362-A | Process for producing ecteinascidin compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-02-24 | — | — | US | claimed |
| US-5721362-A | Process for producing ecteinascidin compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-02-24 | — | — | US | disclosed |