Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 5/20 | 0.48 |
| ▸ | DDIT3 | P35638 | 1/20 | 0.47 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL19454668 | 0.91 | CA12 (0.53) | CA12CA2CA1NAMPTDDIT3 | |
| SCHEMBL12852686 | 0.80 | KIF18A (0.48) | ALDH1A1LMNAMAPTSMN1; SMN2HPGD | |
| SCHEMBL11507747 | 0.79 | ALDH1A1 (0.56) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL14227971 | 0.77 | ALDH1A1 (0.53) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL8784618 | 0.76 | SMN1; SMN2 (0.73) | ALDH1A1LMNASMN1; SMN2CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL27999953 | 0.76 | CA12 (0.42) | CA12CA2CA1NAMPTDDIT3 | |
| SCHEMBL25296150 | 0.76 | MAPK1 (0.56) | CA12CA2NAMPTDDIT3ALDH1A1 | |
| SCHEMBL765653 | 0.76 | ALDH1A1 (0.49) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL20379865 | 0.76 | TSHR (0.46) | CA12CA2CA1NAMPTDDIT3 | |
| SCHEMBL31518328 | 0.76 | NAMPT (0.45) | NAMPTDDIT3PIP4K2AALDH1A1PIK3C3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103384668-B | compounds and compositions for inhibition of NAMPT | 福马TM有限责任公司 | 2017-05-31 | — | — | CN | disclosed |