Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 1/20 | 0.44 |
| ▸ | FKBP1A | P62942 | 5/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.43 |
| ▸ | FNTB | P49356 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.43 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | PREP | P48147 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27896408 | 0.85 | MC4R (0.48) | KDM4EALDH1A1POLBDPP4PREP | |
| SCHEMBL27896420 | 0.81 | NAPRT (0.42) | SIGMAR1KDM4EALDH1A1VNN1FNTA | |
| SCHEMBL27879658 | 0.80 | PREP (0.49) | ALDH1A1VNN1POLBDPP4PREP | |
| SCHEMBL27879612 | 0.78 | SMN1; SMN2 (0.57) | ALDH1A1POLB | |
| SCHEMBL30874798 | 0.77 | VNN1 (0.62) | SIGMAR1KDM4EALDH1A1VNN1FKBP1A | |
| SCHEMBL13272490 | 0.77 | FKBP1A (0.48) | SIGMAR1KDM4EALDH1A1VNN1FKBP1A | |
| SCHEMBL27879616 | 0.76 | HRH3 (0.49) | SIGMAR1ALDH1A1FKBP1APOLBPARP1 | |
| SCHEMBL28054730 | 0.76 | ADAM17 (0.41) | KDM4EALDH1A1CYP3A4CYP2C9DPP4 | |
| SCHEMBL31328333 | 0.76 | KDM4E (0.61) | KDM4EALDH1A1FNTAFNTBPOLB | |
| SCHEMBL26126730 | 0.76 | KDM4E (0.61) | KDM4EALDH1A1FNTAFNTBPOLB |
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-102791693-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2012-11-21 | — | — | CN | claimed |