Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM6B | O15054 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL22452936 | 0.89 | NR1H4 (0.35) | CYP1A2MEN1KMT2ANR1H4ALDH1A1 | |
| SCHEMBL22453719 | 0.88 | CYP1A2 (0.37) | CYP1A2KDM4CMEN1KMT2AKDM6B | |
| SCHEMBL22452558 | 0.88 | KDM4C (0.42) | KDM4CMEN1KMT2AKDM6BKDM4E | |
| SCHEMBL22453716 | 0.83 | PDCD1 (0.36) | CYP1A2KDM4CMEN1KMT2AKDM6B | |
| SCHEMBL22453584 | 0.83 | HDAC3 (0.44) | MAPTSMN1; SMN2NPC1 | |
| SCHEMBL22453579 | 0.81 | CYP1A2 (0.42) | CYP1A2KDM4CKDM6BKDM4ELMNA | |
| SCHEMBL22452937 | 0.81 | DHODH (0.40) | CYP1A2MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL22453585 | 0.81 | CYP1A2 (0.38) | CYP1A2MEN1KMT2AKDM4ENR1H4 | |
| SCHEMBL22453582 | 0.79 | KDM4C (0.41) | CYP1A2KDM4CMEN1KMT2AKDM4E | |
| SCHEMBL22453086 | 0.78 | SERPINE1 (0.35) | KDM4CKMT2AKDM4ELMNAALDH1A1 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |