Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL21056614 | 0.85 | KMT2A (0.76) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL25029977 | 0.85 | KMT2A (0.46) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL31467338 | 0.85 | KMT2A (0.46) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL31139900 | 0.85 | KMT2A (0.46) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL10691721 | 0.84 | LMNA (0.53) | KMT2AMEN1POLBLMNAL3MBTL1 | |
| SCHEMBL10693538 | 0.80 | P2RX7 (0.43) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL10685501 | 0.80 | LMNA (0.58) | KMT2AMEN1POLBLMNAL3MBTL1 | |
| SCHEMBL10689152 | 0.76 | LMNA (0.55) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL10572040 | 0.75 | CA1 (0.40) | KMT2AMEN1POLBLMNACA1 | |
| SCHEMBL5685793 | 0.75 | MEN1 (0.50) | KMT2AMEN1POLBLMNANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4731457-A | 1-substituted, 2,3-diphenyl-3-hydroxymethyl pyrrolidines, where the 2- and/or 3-phenyl can be substituted | THE PURDUE FREDERICK COMPANY (US) | 1988-03-15 | — | — | US | disclosed |
| US-4639529-A | Analgesic and anti-inflammatory compounds | THE PURDUE FREDERICK COMPANY (US) | 1987-01-27 | — | — | US | disclosed |