Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | AOC1 | P19801 | 2/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1735616 | 0.85 | ROCK2 (0.55) | LMNAALDH1A1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL4528495 | 0.81 | KEAP1 (0.65) | RORC | |
| SCHEMBL2481375 | 0.81 | TNF (0.49) | TNFHDAC6TRPV1LMNAALDH1A1 | |
| SCHEMBL2622216 | 0.80 | LATS1 (0.46) | TNFHDAC6RORCTRPV1LMNA | |
| SCHEMBL30645377 | 0.78 | MEN1 (0.53) | HDAC6TRPV1ALDH1A1MAPTKMT2A | |
| SCHEMBL9651248 | 0.78 | MEN1 (0.53) | HDAC6TRPV1ALDH1A1MAPTKMT2A | |
| SCHEMBL30600745 | 0.75 | TRPV1 (0.52) | TNFHDAC6TRPV1ALDH1A1MAPT | |
| SCHEMBL49308 | 0.74 | KEAP1 (0.61) | LMNAALDH1A1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL17737617 | 0.74 | RECQL (0.69) | ALDH1A1MAPTKMT2AALOX12 | |
| SCHEMBL2321594 | 0.74 | KDM4E (0.67) | TNFHDAC6TRPV1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020047208-A1 | INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN | MORPHIC THERAPEUTIC, INC. (US) | 2020-03-05 | — | — | WO | disclosed |
| CN-110669058-A | Tricyclic quinolone carboxylic acid and preparation method thereof | 江西农业大学 | 2020-01-10 | — | — | CN | disclosed |