Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 6/20 | 0.42 |
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | CTSH | P09668 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | CPA3 | P15088 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21850411 | 0.91 | TSHR (0.49) | TSHRACENPC1RAB9ACHRM1 | |
| SCHEMBL21850415 | 0.85 | ACE (0.47) | TSHRCTSKCTSLCTSBCTSH | |
| SCHEMBL17901409 | 0.83 | ALPI (0.41) | CTSKCTSLCTSBCTSHPOLB | |
| SCHEMBL4965733 | 0.79 | TSHR (0.53) | TSHRCTSKCTSLCTSBCTSH | |
| SCHEMBL21850386 | 0.77 | TSHR (0.47) | TSHRACENPC1RAB9ACPA3 | |
| SCHEMBL27484932 | 0.76 | CTSK (0.50) | TSHRCTSKCTSLCTSBCTSH | |
| SCHEMBL21850413 | 0.76 | TRPA1 (0.44) | TSHR | |
| SCHEMBL21850346 | 0.75 | LDHA (0.53) | CYP1A2 | |
| SCHEMBL23494910 | 0.74 | TSHR (0.47) | TSHRPOLBACENPC1RAB9A | |
| SCHEMBL9467203 | 0.74 | TSHR (0.47) | TSHRPOLBACENPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3240408-B1 | PICOLINAMIDES WITH FUNGICIDAL ACTIVITY | DOW AGROSCIENCES LLC (US) | 2020-04-08 | — | — | EP | disclosed |