Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 5/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 5/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 5/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 5/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 5/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4575667 | 0.81 | ALDH1A1 (0.33) | ALDH1A1TDP1CYP3A4TSHRGRIN2D | |
| SCHEMBL7557564 | 0.81 | GRIN2D (0.34) | ALDH1A1TDP1CYP3A4CYP1A2TSHR | |
| SCHEMBL28117836 | 0.74 | TSHR (0.39) | ALDH1A1TDP1CYP3A4CYP1A2TSHR | |
| SCHEMBL7832148 | 0.67 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP1A2TSHRHSD17B10 | |
| SCHEMBL6036197 | 0.64 | ALDH1A1 (0.33) | ALDH1A1TSHRLMNAMAPT | |
| SCHEMBL4576154 | 0.64 | ALDH1A1 (0.39) | ALDH1A1CYP1A2LMNAMAPTKDM4E | |
| SCHEMBL4575201 | 0.64 | MAPK1 (0.35) | PTGS2 | |
| SCHEMBL11503297 | 0.63 | KMT2A (0.40) | ALDH1A1TDP1CYP3A4CYP1A2TSHR | |
| SCHEMBL11375536 | 0.63 | ALDH1A1 (0.48) | ALDH1A1TDP1CYP3A4CYP1A2TSHR | |
| SCHEMBL23257600 | 0.62 | MAPT (0.46) | ALDH1A1TDP1CYP3A4CYP1A2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | claimed |
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | disclosed |