Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 7/20 | 0.52 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.45 |
| ▸ | ANPEP | P15144 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2707643 | 0.93 | MMP2 (0.59) | MMP2USP30ANPEPNR1H2KDM4E | |
| SCHEMBL2709145 | 0.93 | MMP2 (0.59) | MMP2USP30ANPEPNR1H2KDM4E | |
| SCHEMBL29548256 | 0.92 | MMP2 (0.64) | MMP2USP30ANPEPNPC1NR1H2 | |
| SCHEMBL29548777 | 0.91 | MMP2 (0.49) | MMP2USP30ANPEPNPC1NR1H2 | |
| SCHEMBL12609045 | 0.90 | MMP2 (0.52) | MMP2USP30ANPEPNPC1NR1H2 | |
| SCHEMBL29548395 | 0.89 | USP30 (0.57) | MMP2USP30ANPEPNPC1NR1H2 | |
| SCHEMBL29548707 | 0.86 | NR1H2 (0.42) | MMP2NPC1NR1H2KDM4EPKM | |
| SCHEMBL3110842 | 0.84 | MMP2 (0.73) | MMP2USP30ANPEPNR1H2KDM4E | |
| SCHEMBL6365330 | 0.84 | MMP2 (0.73) | MMP2USP30ANPEPNR1H2KDM4E | |
| SCHEMBL3110836 | 0.84 | MMP2 (0.73) | MMP2USP30ANPEPNR1H2KDM4E |
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-2022087630-A1 | INHIBITORS OF AMINO ACID TRANSPORT | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2022-04-28 | — | — | WO | disclosed |