Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL10951607 | 0.80 | TSHR (0.64) | TSHRNAPRTTDP1NOTUMKMT2A | |
| Pyridine SCHEMBL28282157 | 0.79 | NAPRT (0.53) | TSHRNAPRTTDP1NOTUMKDM4E | |
| Pyridine SCHEMBL9037865 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| Pyridine SCHEMBL933604 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| SCHEMBL34466311 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| SCHEMBL3052767 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| Benzene SCHEMBL10751789 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| Pyridine SCHEMBL16 | 0.75 | — | — | |
| Benzene SCHEMBL1261317 | 0.75 | TSHR (1.00) | TSHRNAPRTTDP1NOTUMKMT2A | |
| Pyridine SCHEMBL1654468 | 0.75 | — | — |
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-1973899-A2 | INHIBITORS OF IAP | Genentech, Inc. (US) | 2008-10-01 | — | — | EP | disclosed |
| WO-2007106192-A2 | INHIBITORS OF IAP | GENENTECH, INC. (US) | 2007-09-20 | — | — | WO | disclosed |