Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | DAO | P14920 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP2A13 | Q16696 | 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 | |
|---|---|---|---|---|
| SCHEMBL16016173 | 0.82 | TAAR1 (0.42) | TAAR1CTBP2CHRM2PTGS1PTGS2 | |
| SCHEMBL19480949 | 0.78 | TAAR1 (0.41) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL30148119 | 0.77 | HTR2A (0.53) | TSHRKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL23852714 | 0.76 | TAAR1 (0.50) | TAAR1CA12CA2CA9TSHR | |
| SCHEMBL21594255 | 0.76 | HTR3E (0.55) | TAAR1DAOCHRM2 | |
| SCHEMBL28860982 | 0.76 | TAAR1 (0.50) | TAAR1 | |
| SCHEMBL28310166 | 0.76 | TAAR1 (0.52) | TAAR1DAO | |
| SCHEMBL13460494 | 0.76 | TAAR1 (0.55) | TAAR1CA12CA1CA2CA9 | |
| SCHEMBL143962 | 0.75 | TAAR1 (0.71) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL13692544 | 0.74 | TAAR1 (0.38) | TAAR1ACHEKMT2AMEN1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843338-A | Containing PSMA inhibitors18F-labelled triazoles | 康奈尔大学 | 2019-06-04 | — | — | CN | disclosed |