Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 2/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2989944 | 0.85 | POLB (0.63) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL27381281 | 0.77 | POLB (0.66) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL4135919 | 0.74 | POLB (0.62) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL14022792 | 0.73 | LMNA (0.47) | POLBKMT2ALMNAHPGDSMN1; SMN2 | |
| SCHEMBL14022031 | 0.73 | LMNA (0.47) | POLBKMT2ALMNAHPGDSMN1; SMN2 | |
| SCHEMBL18095786 | 0.72 | POLB (0.60) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL335140 | 0.72 | POLB (0.60) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL8521832 | 0.72 | GABRA1 (0.58) | POLBTSHRGABRA1GABRB2KMT2A | |
| SCHEMBL10243952 | 0.72 | POLB (0.51) | POLBTSHRGABRA1GABRB2MAPKAPK2 | |
| SCHEMBL5623571 | 0.72 | POLB (0.54) | POLBTSHRGABRA1GABRB2KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2670765-A1 | C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY | Bristol-Myers Squibb Company (US) | 2013-12-11 | — | — | EP | disclosed |
| WO-2012106190-A1 | C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-08-09 | — | — | WO | disclosed |