Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24816150 | 1.00 | NAMPT (0.42) | NAMPTALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL24815708 | 0.85 | ALDH1A1 (0.43) | NAMPTALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL26845894 | 0.84 | ALDH1A1 (0.41) | NAMPTALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL24814435 | 0.82 | HSD17B3 (0.43) | ALDH1A1SMN1; SMN2KDM4EMAPTKMT2A | |
| SCHEMBL24815709 | 0.81 | NAMPT (0.44) | NAMPTALDH1A1SMN1; SMN2RAB9AKMT2A | |
| SCHEMBL24815712 | 0.81 | MAOB (0.41) | NAMPTALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL29986261 | 0.81 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2KDM4EMAPTRAB9A | |
| SCHEMBL24814434 | 0.81 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2KDM4EMAPTRAB9A | |
| SCHEMBL24816166 | 0.79 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL24815667 | 0.79 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A |
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-2022251343-A2 | CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF | NATIONAL HEALTH RESEARCH INSTITUTES (TW) | 2022-12-01 | — | — | WO | disclosed |