Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7260977 | 0.85 | AKR1C3 (0.37) | KDM4EGAAMAPTPOLBLMNA | |
| SCHEMBL28372820 | 0.81 | KMT2A (0.38) | KDM4EGAAMAPTMEN1POLB | |
| SCHEMBL30825759 | 0.77 | EPHX1 (0.38) | EPHX1KDM4EGAAMAPTNAPRT | |
| SCHEMBL27670390 | 0.76 | RAB9A (0.37) | KDM4EGAAMAPTMEN1POLB | |
| SCHEMBL27595427 | 0.76 | TSHR (0.34) | KDM4EGAAMAPTMEN1POLB | |
| SCHEMBL27694907 | 0.76 | TSHR (0.34) | KDM4EGAAMAPTMEN1POLB | |
| SCHEMBL10367905 | 0.74 | CNR2 (0.38) | MAPTTSHR | |
| SCHEMBL5315527 | 0.73 | NAPRT (0.34) | KDM4EGAAMAPTTSHRNAPRT | |
| SCHEMBL9752697 | 0.72 | — | — | |
| SCHEMBL1999841 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116171272-A | Novel VDAC1 inhibitors | 阿巴尔塞奥制药公司 | 2023-05-26 | — | — | CN | disclosed |
| US-6323344-B1 | HYDROLYZING 5-BENZOYL-2,3-DIHYDRO-1H-PYRROLIZINE-1-CARBOXAMIDES COMPOUND IN PRESENCE OF STRONG BASE TO FORM KETOROLAC | SYNTEX (U.S.A.) INC. | 2001-11-27 | — | — | US | disclosed |
| US-6197976-B1 | ACYLATION, SALT FORMATION, DEAMINATION | SYNTEX (U.S.A.) LLC | 2001-03-06 | — | — | US | disclosed |