Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RXRA | P19793 | 2/20 | 0.38 |
| ▸ | RXRB | P28702 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL29220383 | 0.77 | ATM (0.30) | — | |
| SCHEMBL3587300 | 0.74 | MAPT (0.46) | TPMTTSHRALDH1A1IDO1LMNA | |
| SCHEMBL9275420 | 0.74 | PARP1 (0.54) | TSHRALDH1A1CTSLRAB9A | |
| SCHEMBL4091956 | 0.71 | TSHR (0.57) | TPMTTSHRHCAR1ALDH1A1RXRA | |
| SCHEMBL28214359 | 0.71 | TPMT (1.00) | TPMTTSHRHCAR1ALDH1A1RXRA | |
| SCHEMBL23699 | 0.71 | TPMT (1.00) | TPMTTSHRHCAR1ALDH1A1RXRA | |
| SCHEMBL16959382 | 0.71 | TPMT (0.55) | TPMTTSHRHCAR1ALDH1A1RXRA | |
| SCHEMBL11367245 | 0.71 | TSHR (0.55) | TSHRALDH1A1LMNAMAPTCYP3A4 | |
| Hydrochloric Acid SCHEMBL10387707 | 0.69 | TPMT (0.94) | TPMTTSHRHCAR1ALDH1A1RXRA | |
| 1,3,5-Trichlorobenzene SCHEMBL429512 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5204482-A | Ethylenediamine monoamide heteroaryl derivatives | HOFFMAN-LAROCHE INC. (US) | 1993-04-20 | — | — | US | disclosed |
| US-5011849-A | Monoamine oxidase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 1991-04-30 | — | — | US | disclosed |