Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL24803337 | 0.86 | ABCC1 (0.47) | MEN1KMT2ALMNAHPGDABCC1 | |
| SCHEMBL23978750 | 0.86 | ABCC1 (0.47) | MEN1KMT2ALMNAHPGDABCC1 | |
| SCHEMBL23978690 | 0.79 | ALDH1A1 (0.49) | KMT2ALMNAALDH1A1CA12CA9 | |
| SCHEMBL24803336 | 0.78 | SYK (0.52) | MEN1KMT2ALMNAMAPT | |
| SCHEMBL23978700 | 0.78 | SYK (0.52) | MEN1KMT2ALMNAMAPT | |
| SCHEMBL23979013 | 0.78 | NPC1 (0.53) | MEN1KMT2AHPGDABCC1NPC1 | |
| SCHEMBL27690076 | 0.77 | ALDH1A1 (0.53) | KMT2ALMNAHPGDNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL7373367 | 0.76 | MMP2 (0.54) | KMT2ALMNAHPGDRAB9AALDH1A1 | |
| SCHEMBL7300508 | 0.76 | MMP2 (0.56) | KMT2ALMNAHPGDRAB9AALDH1A1 | |
| SCHEMBL23979133 | 0.75 | RAB9A (0.50) | KMT2ALMNAHPGDABCC1NPC1 |
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-2021222789-A1 | INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-04 | — | — | WO | disclosed |