Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 4/20 | 0.46 |
| ▸ | F9 | P00740 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | F12 | P00748 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | F7 | P08709 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.44 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL21854853 | 0.92 | HTR2C (0.47) | F2F9F10F12PRSS1 | |
| Trifluoroacetic Acid SCHEMBL21854670 | 0.88 | KDM4E (0.52) | F10KMT2AHTR2CCTRB1TSHR | |
| Trifluoroacetic Acid SCHEMBL21854716 | 0.86 | CTRB1 (0.52) | KMT2AHTR2CCTRB1TSHRPDK1 | |
| SCHEMBL2439873 | 0.86 | TSHR (0.48) | KMT2AHDAC1HTR2CMC4RCTRB1 | |
| SCHEMBL2439870 | 0.86 | TSHR (0.48) | KMT2AHDAC1HTR2CMC4RCTRB1 | |
| Trifluoroacetic Acid SCHEMBL28969098 | 0.86 | PRCP (0.61) | F2F9F10F12PRSS1 | |
| Trifluoroacetic Acid SCHEMBL30253251 | 0.86 | HTR2C (0.46) | KMT2AHTR2CCTRB1FKBP1ATSHR | |
| SCHEMBL1257136 | 0.82 | HTR2C (0.50) | KMT2AHTR2CCTRB1CYP3A4MAPT | |
| SCHEMBL21854732 | 0.82 | HTR2C (0.51) | KMT2AHTR2CCTRB1TSHRRAB9A | |
| SCHEMBL8707997 | 0.81 | NPSR1 (0.49) | KMT2AHTR2CCTRB1FKBP1ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020081917-A1 | ΒETA-CATENIN AND B-CELL LYMPHOMA 9 (BCL9) INHIBITORS | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2020-04-23 | — | — | WO | disclosed |