Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CFB | P00751 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MMP14 | P50281 | 1/20 | 0.34 |
| ▸ | HPGDS | O60760 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Abafungin SCHEMBL301669 | 0.94 | MEN1 (0.42) | MEN1KMT2AATMMAPTALDH1A1 | |
| Abafungin SCHEMBL29517947 | 0.94 | MEN1 (0.42) | MEN1KMT2AATMMAPTALDH1A1 | |
| Abafungin SCHEMBL10455902 | 0.93 | MEN1 (0.41) | MEN1KMT2AATMMAPTALDH1A1 | |
| Abafungin SCHEMBL28223793 | 0.92 | MEN1 (0.37) | MEN1KMT2AATMMAPTALDH1A1 | |
| SCHEMBL8310278 | 0.79 | VCP (0.44) | MEN1KMT2AATMMAPTALDH1A1 | |
| SCHEMBL24996622 | 0.75 | PTGS2 (0.38) | MEN1KMT2AMAPTALDH1A1TDP1 | |
| SCHEMBL3605029 | 0.71 | ATP4A (0.45) | MEN1KMT2AATMMAPTALDH1A1 | |
| Abafungin SCHEMBL301668 | 0.71 | MAPT (0.39) | MEN1KMT2AATMMAPTALDH1A1 | |
| SCHEMBL24996623 | 0.69 | KDM4E (0.39) | MEN1KMT2AATMMAPTCFB | |
| SCHEMBL10455731 | 0.69 | ALOX5 (0.44) | MEN1KMT2AMAPTALDH1A1PTGS2 |
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-109310660-A | Therapeutic combination and application thereof | 蜜纽康新西兰有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-106455705-A | Methods and devices for smoking urge relief | 方特慕控股第私人有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-105848680-A | Treatment using bruton's tyrosine kinase inhibitors and immunotherapy | 药品循环有限责任公司 | 2016-08-10 | — | — | CN | disclosed |