Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | DAO | P14920 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL143962 | 0.78 | TAAR1 (0.71) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL376960 | 0.77 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL29957198 | 0.77 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| O-Xylene SCHEMBL11164671 | 0.76 | TAAR1 (0.68) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL7454141 | 0.75 | TAAR1 (0.60) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL29956636 | 0.74 | TAAR1 (0.56) | TAAR1DAOKMT2AHPGDLMNA | |
| SCHEMBL6546881 | 0.74 | TAAR1 (0.65) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL6546757 | 0.74 | TAAR1 (0.65) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL8099979 | 0.72 | TAAR1 (0.62) | TAAR1DAOCA12CA1CA2 | |
| SCHEMBL8093093 | 0.72 | TAAR1 (0.62) | TAAR1DAOCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |