Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.79 |
| ▸ | DAO | P14920 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PHGDH | O43175 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.47 |
| ▸ | CCR2 | P41597 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL117186 | 0.89 | MCL1 (1.00) | MCL1DAOALDH1A1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL8600262 | 0.87 | MCL1 (0.96) | MCL1DAOALDH1A1KDM4EHPGD | |
| SCHEMBL3486847 | 0.82 | MCL1 (0.56) | MCL1DAOALDH1A1KDM4EHPGD | |
| SCHEMBL8616489 | 0.80 | MCL1 (0.53) | MCL1DAOALDH1A1KDM4EHPGD | |
| Guanidine SCHEMBL8688091 | 0.80 | MCL1 (0.81) | MCL1DAOALDH1A1KDM4EHPGD | |
| SCHEMBL335459 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL5395245 | 0.78 | RAB9A (0.53) | HSD17B10MAPTSMN1; SMN2MEN1NPC1 | |
| SCHEMBL16599480 | 0.77 | MCL1 (0.76) | MCL1DAOSLC9A1MAPTPHGDH | |
| Hydrazine SCHEMBL3522472 | 0.76 | RAB9A (0.51) | HSD17B10MAPTSMN1; SMN2MEN1NPC1 | |
| SCHEMBL27467673 | 0.76 | MCL1 (0.74) | MCL1DAOALDH1A1SLC9A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010118241-A2 | INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES | INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) | 2010-10-14 | — | — | WO | disclosed |